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Sample records for dimethyl ether dme-fueled

  1. DIMETHYL ETHER (DME)-FUELED SHUTTLE BUS DEMONSTRATION PROJECT

    Energy Technology Data Exchange (ETDEWEB)

    Elana M. Chapman; Shirish Bhide; Jennifer Stefanik; Howard Glunt; Andre L. Boehman; Allen Homan; David Klinikowski

    2003-04-01

    The objectives of this research and demonstration program are to convert a campus shuttle bus to operation on dimethyl ether, a potential ultra-clean alternative diesel fuel. To accomplish this objective, this project includes laboratory evaluation of a fuel conversion strategy, as well as, field demonstration of the DME-fueled shuttle bus. Since DME is a fuel with no lubricity (i.e., it does not possess the lubricating quality of diesel fuel), conventional fuel delivery and fuel injection systems are not compatible with dimethyl ether. Therefore, to operate a diesel engine on DME one must develop a fuel-tolerant injection system, or find a way to provide the necessary lubricity to the DME. In this project, they have chosen the latter strategy in order to achieve the objective with minimal need to modify the engine. Their strategy is to blend DME with diesel fuel, to obtain the necessary lubricity to protect the fuel injection system and to achieve low emissions. The bulk of the efforts over the past year were focused on the conversion of the campus shuttle bus. This process, started in August 2001, took until April 2002 to complete. The process culminated in an event to celebrate the launching of the shuttle bus on DME-diesel operation on April 19, 2002. The design of the system on the shuttle bus was patterned after the system developed in the engine laboratory, but also was subjected to a rigorous failure modes effects analysis (FMEA, referred to by Air Products as a ''HAZOP'' analysis) with help from Dr. James Hansel of Air Products. The result of this FMEA was the addition of layers of redundancy and over-pressure protection to the system on the shuttle bus. The system became operational in February 2002. Preliminary emissions tests and basic operation of the shuttle bus took place at the Pennsylvania Transportation Institute's test track facility near the University Park airport. After modification and optimization of the system on

  2. Direct dimethyl ether fueling of a high temperature polymer fuel cell

    DEFF Research Database (Denmark)

    Jensen, Jens Oluf; Vassiliev, Anton; Olsen, M.I.

    2012-01-01

    Direct dimethyl ether (DME) fuel cells suffer from poor DME–water miscibility and so far peak powers of only 20–40 mW cm−2 have been reported. Based on available literature on solubility of dimethyl ether (DME) in water at ambient pressure it was estimated that the maximum concentration of DME at...

  3. Numerical and Experimental Study on the Combustion and Emission Characteristics of a Dimethyl Ether (DME Fueled Compression Ignition Engine Études numériques et expérimentales sur les caractéristiques de combustion et d’émissions d’un éther diméthylique (EDM- moteur à auto-allumage rempli de combustible

    Directory of Open Access Journals (Sweden)

    Kim Hyung Jun

    2012-05-01

    Full Text Available A numerical investigation was carried out to study on the combustion and emission characteristics of dimethyl ether (DME with wide ranges of injection timings in compression ignition engines. In order to simulate DME combustion processes, a KIVA-3V code coupled with a chemistry solver was used to solve the detailed chemical kinetics model of DME oxidation. In addition, the Kelvin-Helmholtz-Rayleigh-Taylor (KH-RT hybrid breakup model and Renormalization Group (RNG k-ε  models were applied to analyze the spray characteristics and turbulent flow, respectively. To predict the NOx formation during DME combustion, a reduced Gas Research Institute (GRI NO mechanism was used. From these results on the combustion and emission, the calculated results were compared with experimental ones for the same operating conditions. In the combustion characteristics, the calculated combustion pressure and heat release rates agreed well with experimental results. The levels of experimental NOx emissions was reduced as the start of the injection timing retarded, and also these trends appeared in calculated emission characteristics. Additionally, the calculated CO and HC emissions show an increasing trend as the start of the injection is retarded. Dans cette étude, nous considérons la simulation de la combustion du dimethyl ether (DME dans un moteur à allumage par compression. Les caractéristiques de la combustion ainsi que les émissions polluantes sont analysées sur une large gamme d’avance à l’injection. Afin de simuler le processus de combustion du EDM, le code KIVA-3V couplé à un solveur chimique a été utilisé pour résoudre la cinétique détaillée de l’oxydation du EDM. Le modèle de rupture de Kelvin-Helmholtz-Rayleigh- Taylor (KH-RT ainsi que le modèle de turbulence k-ε  RNG ont été appliqués pour analyser respectivement les caractéristiques du jet et l’écoulement turbulent. Pour prévoir la formation de NOx pendant la combustion

  4. Catalytic oxidation of dimethyl ether

    Science.gov (United States)

    Zelenay, Piotr; Wu, Gang; Johnston, Christina M.; Li, Qing

    2016-05-10

    A composition for oxidizing dimethyl ether includes an alloy supported on carbon, the alloy being of platinum, ruthenium, and palladium. A process for oxidizing dimethyl ether involves exposing dimethyl ether to a carbon-supported alloy of platinum, ruthenium, and palladium under conditions sufficient to electrochemically oxidize the dimethyl ether.

  5. Technoeconomic analysis of a low CO2 emission dimethyl ether (DME) plant based on gasification of torrefied biomass

    DEFF Research Database (Denmark)

    Clausen, Lasse Røngaard; Elmegaard, Brian; Houbak, Niels

    2010-01-01

    Two models of a dimethyl ether (DME) fuel production plant were designed and analyzed in DNA and Aspen Plus. The plants produce DME by either recycle (RC) or once through (OT) catalytic conversion of a syngas generated by gasification of torrefied woody biomass. Torrefication is a mild pyrolysis...

  6. Direct dimethyl ether high temperature polymer electrolyte membrane fuel cells

    DEFF Research Database (Denmark)

    Vassiliev, Anton; Jensen, Jens Oluf; Li, Qingfeng

    and suffers from low DME solubility in water. When the DME - water mixture is fed as vapour miscibility is no longer a problem. The increased temperature is more beneficial for the kinetics of the direct oxidation of DME than of methanol. The Open Circuit Voltage (OCV) with DME operation was 50 to 100 m......A high temperature polybenzimidazole (PBI) polymer fuel cell was fed with dimethyl ether (DME) and water vapour mixture on the anode at ambient pressure with air as oxidant. A peak power density of 79 mW/cm2 was achieved at 200°C. A conventional polymer based direct DME fuel cell is liquid fed...

  7. New controllable premixed combustion for dimethyl ether engine

    Institute of Scientific and Technical Information of China (English)

    2003-01-01

    A new concept of the controllable premixed combustion (CPC) system was proposed for dimethyl ether (DME) to explore a new approach to achieving ultra-low NOX emissions with the zero level of particulate matter exhaust emissions. The DME fuel was injected into the premix chamber by means of the electronically controlled low pressure injection system, then the mixture formation and combustion process were controlled with a control-valve set between the main chamber and the premix chamber. The test bench was constructed based on a single diesel engine. Preliminary studies demonstrated that ultra-low NOX emissions had been realized with zero particulate matter emissions under the optimum specifications of the DME engine, NOX emissions were less than 65 × 10-6. According to the engine combustion analysis, it was found that the control-valve played an important role in the pre-mixture formation and ignition timing.

  8. Direct Dimethyl Ether Synthesis

    Institute of Scientific and Technical Information of China (English)

    Takashi Ogawa; Norio Inoue; Tutomu Shikada; Yotaro Ohno

    2003-01-01

    Dimethyl ether (DME) is a clean and economical alternative fuel which can be produced from natural gas through synthesis gas. The properties of DME are very similar to those of LP gas. DME can be used for various fields as a fuel such as power generation, transportation, home heating and cooking,etc. It contains no sulfur or nitrogen. It is not corrosive to any metal and not harmful to human body. An innovative process of direct synthesis of DME from synthesis gas has been developed. Newly developed catalyst in a slurry phase reactor gave a high conversion and high selectivity of DME production. One and half year pilot scale plant (5 tons per day) testing, which was supported by METI, had successfully finished with about 400 tons DME production.

  9. The viscosity of dimethyl ether

    DEFF Research Database (Denmark)

    Sivebæk, Ion Marius; Jakobsen, Jørgen

    2007-01-01

    Dimethyl ether (DME) has been recognised as an excellent fuel for diesel engines for over one decade now. Engines fuelled by DME emit virtually no particulate matter even at low NOx levels. This is only possible in the case of diesel oil operation if expensive and efficient lowering particles...... for pressurisation in these methods. The results of the VFVM are consolidated by measurements of the viscosities of propane and butane: these agree with the outcome of measurements using a quartz crystal microbalance (QCM) a method that is supposedly less sensible than the Reynolds number....

  10. Thermodynamic equilibrium calculations of dimethyl ether steam reforming and dimethyl ether hydrolysis

    Science.gov (United States)

    Semelsberger, Troy A.; Borup, Rodney L.

    The production of a hydrogen-rich fuel-cell feed by dimethyl ether (DME) steam reforming was investigated using calculations of thermodynamic equilibrium as a function of steam-to-carbon ratio (0.00-4.00), temperature (100-600 °C), pressure (1-5 atm), and product species. Species considered were acetone, acetylene, carbon dioxide, carbon monoxide, dimethyl ether, ethane, ethanol, ethylene, formaldehyde, formic acid, hydrogen, isopropanol, methane, methanol, methyl-ethyl ether, n-propanol and water. Thermodynamic equilibrium calculations of DME steam reforming indicate complete conversion of dimethyl ether to hydrogen, carbon monoxide and carbon dioxide at temperatures greater than 200 °C and steam-to-carbon ratios greater than 1.25 at atmospheric pressure ( P = 1 atm). Increasing the operating pressure shifts the equilibrium toward the reactants; increasing the pressure from 1 to 5 atm decreases the conversion of dimethyl ether from 99.5 to 76.2%. The trend of thermodynamically stable products in decreasing mole fraction is methane, ethane, isopropyl alcohol, acetone, n-propanol, ethylene, ethanol, methyl-ethyl ether and methanol-formaldehyde, formic acid, and acetylene were not observed. Based on the equilibrium calculations, the optimal processing conditions for dimethyl ether steam reforming occur at a steam-to-carbon ratio of 1.50, a pressure of 1 atm, and a temperature of 200 °C. These thermodynamic equilibrium calculations show dimethyl ether processed with steam will produce hydrogen-rich fuel-cell feeds—with hydrogen concentrations exceeding 70%. The conversion of dimethyl ether via hydrolysis (considering methanol as the only product) is limited by thermodynamic equilibrium. Equilibrium conversion increases with temperature and steam-to-carbon ratio. A maximum dimethyl ether conversion of 62% is achieved at a steam-to-carbon ratio of 5.00 and a processing temperature of 600 °C.

  11. Converting biogenic dimethyl ether into fuels

    Energy Technology Data Exchange (ETDEWEB)

    Zimmermann, Michael; Otto, Thomas N.; Dinjus, Eckhard [Karlsruher Institut fuer Technologie (KIT), Eggenstein-Leopoldshafen (Germany). Inst. fuer Katalyseforschung und -technologie (IKFT)

    2013-06-01

    In the seventies, the MtG (''methanol-to-gasoline'') process was an alternative to the Fischer-Tropsch process developed in the thirties of the past century. The MtG process is performed with dimethyl ether (DME) as an intermediate. Hydrocarbons (C{sub 1}-C{sub 10}) directly synthesised via DME with the assistance of zeolites as catalysts offers considerable advantages over the MtG process. Zeolites play an important role in the production of biomass-based fuels from synthesis gas. Known and mature technologies exist for synthesis gas of fossil origin (coal, natural gas, petroleum). These established technologies may also be transferred to synthesis gas of biogenous origin. Dimethyl ether produced from biomass-based synthesis gas is a central intermediate product. In the MtG and DtG (''dimethyl ether-to-gasoline'') process H-ZSM-5 zeolites are of major significance. Modification of H-ZSM-5 catalysts is the basis of customized product synthesis. Hierarchic structures of zeolites change the diffusion properties of the crystals and can help to achieve a more selective range of products. (orig.)

  12. High-activity PtRuPd/C catalyst for direct dimethyl ether fuel cells.

    Science.gov (United States)

    Li, Qing; Wen, Xiaodong; Wu, Gang; Chung, Hoon T; Gao, Rui; Zelenay, Piotr

    2015-06-22

    Dimethyl ether (DME) has been considered as a promising alternative fuel for direct-feed fuel cells but lack of an efficient DME oxidation electrocatalyst has remained the challenge for the commercialization of the direct DME fuel cell. The commonly studied binary PtRu catalyst shows much lower activity in DME than methanol oxidation. In this work, guided by density functional theory (DFT) calculation, a ternary carbon-supported PtRuPd catalyst was designed and synthesized for DME electrooxidation. DFT calculations indicated that Pd in the ternary PtRuPd catalyst is capable of significantly decreasing the activation energy of the CO and CH bond scission during the oxidation process. As evidenced by both electrochemical measurements in an aqueous electrolyte and polymer-electrolyte fuel cell testing, the ternary catalyst shows much higher activity (two-fold enhancement at 0.5 V in fuel cells) than the state-of-the-art binary Pt50 Ru50 /C catalyst (HiSPEC 12100).

  13. Molecular dynamics model of dimethyl ether

    Energy Technology Data Exchange (ETDEWEB)

    Lin, B.; Halley, W.J. [Univ. of Minnesota, Minneapolis, MN (United States)

    1995-11-02

    We report a molecular dynamics model of the monomeric liquid dimethyl ether. The united atom approach is used to treat CH{sub 3} groups as point source centers. Partial charges are derived from the experimental dipole moment. Harmonic force constants are used for intramolecular interactions, and their values are so chosen that the model`s fundamental frequencies agree with experimental results. Because we are interested in solvation properties, the model contains flexible molecules, allowing molecular distortion and internal dynamical quantities. We report radial distribution functions and the static structure factors as well as some dynamical quantities such as the dynamical structure factor, infrared absorption, and Raman scattering spectra. Calculated results agree reasonably well with experimental and other simulation results. 25 refs., 8 figs., 1 tab.

  14. Conversion of dimethyl ether on zeolite catalysts

    Energy Technology Data Exchange (ETDEWEB)

    Abramova, A.V.; Kulumbegov, R.V.; Khadzhiev, S.N. [Russian Academy of Sciences, Moscow (Russian Federation). A.V. Topchiev Inst. of Petrochemical Synthesis

    2006-07-01

    Catalytic conversion of dimethyl ether to hydrocarbons was investigated using zeolite catalyst ZSM-5 type. 2% MexOy - 60% HZVM(analogue of ZSM-5)/Al{sub 2}O{sub 3}, (Me = Zn, Ga, Fe, Co, V, Ni) catalyst samples have been obtained. The reaction was carried out in a fixed bed reaction set-up at 350-400 C, pressure 3 MPa, gas mix (% vol.): 24 DME, 76 N{sub 2}, WHSV=1300 l/l-{sub kat.}h. Most effective catalysts of DME conversion are pentasil based catalysts with promoter metals zinc, iron and cobalt by totality DME-conversion, gas and liquid hydrocarbon selectivity, ethylene and propylene content in gas. The best work temperatures are 350 and 375 C, thereupon increasing of temperature to 400 C leads to considerable growth of methane in hydrocarbon gas. Liquid hydrocarbons have high content of aromatics and iso-paraffins. Liquid hydrocarbon product is characterized by high octane number (RON) 90-98. (orig.)

  15. Dimethyl ether (DME) as an alternative fuel

    Science.gov (United States)

    Semelsberger, Troy A.; Borup, Rodney L.; Greene, Howard L.

    With ever growing concerns on environmental pollution, energy security, and future oil supplies, the global community is seeking non-petroleum based alternative fuels, along with more advanced energy technologies (e.g., fuel cells) to increase the efficiency of energy use. The most promising alternative fuel will be the fuel that has the greatest impact on society. The major impact areas include well-to-wheel greenhouse gas emissions, non-petroleum feed stocks, well-to-wheel efficiencies, fuel versatility, infrastructure, availability, economics, and safety. Compared to some of the other leading alternative fuel candidates (i.e., methane, methanol, ethanol, and Fischer-Tropsch fuels), dimethyl ether appears to have the largest potential impact on society, and should be considered as the fuel of choice for eliminating the dependency on petroleum. DME can be used as a clean high-efficiency compression ignition fuel with reduced NO x, SO x, and particulate matter, it can be efficiently reformed to hydrogen at low temperatures, and does not have large issues with toxicity, production, infrastructure, and transportation as do various other fuels. The literature relevant to DME use is reviewed and summarized to demonstrate the viability of DME as an alternative fuel.

  16. Dimethyl ether in diesel engines - progress and perspectives

    DEFF Research Database (Denmark)

    Sorenson, Spencer C

    2001-01-01

    A review of recent developments related to the use of dimethyl ether (DME) in engines is presented Research work discussed is in the areas of engine performance and emissions, fuel injection systems, spray and ignition delay, and detailed chemical kinetic modeling. DME's properties and safety...

  17. The effect of gasses on the viscosity of dimethyl ether

    DEFF Research Database (Denmark)

    Sivebæk, Ion Marius; Jakobsen, Jørgen

    2008-01-01

    Dimethyl ether (DME) has been recognised as a clean substitute for diesel oil as it does not form soot during combustion. DME has a vapour pressure of 6 bar at 25 degrees C; so pressurisation is necessary to keep DME liquid at ambient temperature. Inert gases are good candidates as pressurising m...

  18. Conversion Excess Coal Gas to Dimethyl Ether in Steel Works

    Institute of Scientific and Technical Information of China (English)

    2002-01-01

    With the technical progress of metallurgical industry, more excess gas will be produced in steel works. The feasibility of producing dimethyl ether by gas synthesis was discussed, which focused on marketing, energy balance, process design, economic evaluation, and environmental protection etc. DME was considered to be a new way to utilize excess coal gas in steel works.

  19. Effects of dimethyl ether on n-butane oxidation

    OpenAIRE

    Bekat, Tuğçe; İnal, Fikret

    2014-01-01

    Dimethyl ether (DME) is the simplest ether and it is used as an alternative fuel or fuel additive to reduce toxic emissions from combustion processes. The effects of DME on n-butane oxidation were investigated for two different concentrations of DME in the fuel mixture (i.e., 20% and 50%) and two different fuel-rich equivalence ratios (i.e., 2.6 and 3.0) using detailed chemical kinetic modeling. Reactor model was selected as atmospheric-pressure, adiabatic, tubular reactor, operated under lam...

  20. Emission reduction potential of using gas-to-liquid and dimethyl ether fuels on a turbocharged diesel engine.

    Science.gov (United States)

    Xinling, Li; Zhen, Huang

    2009-03-15

    A study of engine performance characteristics and both of regulated (CO, HC, NO(x), and smoke) and unregulated (ultrafine particle number, mass concentrations and size distribution) emissions for a turbocharged diesel engine fueled with conventional diesel, gas-to-liquid (GTL) and dimethyl ether (DME) fuels respectively at different engine loads and speeds have been carried out. The results indicated that fuel components significantly affected the engine performance and regulated/unregulated emissions. GTL exhibited almost the same power and torque output as diesel, while improved fuel economy. GTL significantly reduced regulated emissions with average reductions of 21.2% in CO, 15.7% in HC, 15.6% in NO(x) and 22.1% in smoke in comparison to diesel, as well as average reductions in unregulated emissions of total ultrafine particle number (N(tot)) and mass (M(tot)) emissions by 85.3% and 43.9%. DME can significantly increase torque and power, compared with the original diesel engine, as well as significantly reduced regulated emissions of 40.1% in HC, 48.2% in NO(x) and smoke free throughout all the engine conditions. However, N(tot) for DME is close to that for diesel. The reason is that the accumulation mode particle number emissions for DME are very low due to the characteristics of oxygen content and no C-C bond, which promotes the processes of nucleation and condensation of the semi-volatile compounds in the exhaust gas, as a result, a lot of nucleation mode particles produce.

  1. Intrinsic Kinetics of Dimethyl Ether Synthesis from Syngas

    Institute of Scientific and Technical Information of China (English)

    Zhaoguang Nie; Hongwei Liu; Dianhua Liu; Weiyong Ying; Dingye Fang

    2005-01-01

    The intrinsic kinetics of dimethyl ether (DME) synthesis from syngas over a methanol synthesis catalyst mixed with methanol dehydration catalyst has been investigated in a tubular integral reactor at 3-7 MPa and 220-260 ℃. The three reactions including methanol synthesis from CO and H2, CO2 and H2, and methanol dehydration were chosen as the independent reactions. The L-H kinetic model was presented for dimethyl ether synthesis and the parameters of the model were obtained by using simplex method combined with genetic algorithm. The model is reliable according to statistical analysis and residual error analysis. The synergy effect of the reactions over the bifunctional catalyst was compared with the effect for methanol synthesis catalyst under the same conditions based on the model. The effects of syngas containing N2 on the reactions were also simulated.

  2. Cross sections for electron collisions with dimethyl ether

    OpenAIRE

    Sugohara, RT; Homem, MGP; Iga, I; de Souza, GLC; MACHADO, LE; Ferraz, JR; dos Santos, AS; Brescansin, LM; Lucchese, RR; Lee, MT

    2013-01-01

    We report a joint theoretical-experimental investigation of electron collision with dimethyl ether (DME) in the low- and intermediate-energy ranges. Experimental absolute differential, integral, and momentum-transfer cross sections for elastic e(-)-DME scattering are reported in the 100-1000 eV energy range. Our measurements were performed using a crossed electron-beam-molecular-beam geometry. The angular distribution of the scattered electrons was converted to absolute cross section using th...

  3. Study on Synergy Effect in Dimethyl Ether Synthesis from Syngas

    Institute of Scientific and Technical Information of China (English)

    王志良; 刁杰; 王金福; 金涌

    2001-01-01

    Influence of reaction temperature, pressure and space velocity on the direct synthesis of dimethyl ether (DME) from syngas is studied in an isothermal fixed-bed reactor. The catalyst is a physical mixture of C30 copper-based methanol (MeOH) synthesis catalyst and ZSM-5 dehydration catalyst. The experimental results show that the chemical synergy between methanol synthesis reaction and methanol dehydration reaction is evident. The conversion of carbon monoxide is over 90%.

  4. Homogeneous Charge Compression Ignition Combustion of Dimethyl Ether

    OpenAIRE

    Pedersen, Troels Dyhr; Schramm, Jesper

    2011-01-01

    This thesis is based on experimental and numerical studies on the use of dimethyl ether (DME) in the homogeneous charge compression ignition (HCCI) combustion process. The first paper in this thesis was published in 2007 and describes HCCI combustion of pure DME in a small diesel engine. The tests were designed to investigate the effect of engine speed, compression ratio and equivalence ratio on the combustion timing and the engine performance. It was found that the required compression ratio...

  5. Insight into selected reactions in low-temperature dimethyl ether combustion from Born-Oppenheimer molecular dynamics.

    Science.gov (United States)

    Andersen, Amity; Carter, Emily A

    2006-02-02

    Dimethyl ether is under consideration as an alternative diesel fuel. Its combustion chemistry is as yet ill-characterized. Here we use Born-Oppenheimer molecular dynamics (BOMD) based on DFT-B3LYP forces to investigate the short-time dynamics of selected features of the low-temperature dimethyl ether (DME) oxidation potential energy surface. Along the chain propagation pathway, we run BOMD simulations from the transition state involving the decomposition of (*)CH(2)OCH(2)OOH to two CH(2)=O and an (*)OH radical. We predict that formaldehyde C-O stretch overtones are excited, consistent with laser photolysis experiments. We also predict that O-H overtones are excited for the (*)OH formed from (*)CH(2)OCH(2)OOH dissociation. We also investigate short-time dynamics involved in chain branching. First, we examine the isomerization transition state of (*)OOCH(2)OCH(2)OOH --> HOOCH(2)OCHOOH. The latter species is predicted to be a short-lived metastable radical that decomposes within 500 fs to hydroperoxymethyl formate (HPMF; HOOCH(2)OC(=O)H) and the first (*)OH of chain branching. The dissociation of HOOCH(2)OCHOOH exhibits non-RRKM behavior in its lifetime profile, which may be due to conformational constraints or slow intramolecular vibrational energy transfer (IVR) from the nascent H-O bond to the opposite end of the radical, where O-O scission occurs to form HPMF and (*)OH. In a few trajectories, we see HOOCH(2)OCHOOH recross back to (*)OOCH(2)OCH(2)OOH because the isomerization is endothermic, with only an 8 kcal/mol barrier to recrossing. Therefore, some inhibition of chain-branching may be due to recrossing. Second, trajectories run from the transition state leading to the direct decomposition of HPMF (an important source of the second (*)OH radical in chain branching) to HCO, (*)OH, and HC(=O)OH show that these products can recombine to form many other possible products. These products include CH(2)OO + HC(=O)OH, H(2)O + CO + HC(=O)OH, HC(=O)OH + HC(=O)OH, and HC

  6. Developments of Catalysts for Hydrogen Production from Dimethyl Ether

    Institute of Scientific and Technical Information of China (English)

    Kaoru; Takeishi

    2007-01-01

    1 Results Dimethyl ether (DME) is expected as a clean fuel of the 21st century.I have developed new catalysts for hydrogen production by steam reforming of DME.Cu-Zn/Al2O3 catalysts prepared by the sol-gel method produce large quantities of H2 and CO2 by DME steam reforming under lower reaction temperature[1].However,the sol-gel catalysts will be more expensive than general catalysts prepared by impregnation methods and coprecipitation methods,because the precursor,alkoxides are very expensive.For pract...

  7. Dimethyl ether production from methanol and/or syngas

    Energy Technology Data Exchange (ETDEWEB)

    Dagle, Robert A; Wang, Yong; Baker, Eddie G; Hu, Jianli

    2015-02-17

    Disclosed are methods for producing dimethyl ether (DME) from methanol and for producing DME directly from syngas, such as syngas from biomass. Also disclosed are apparatus for DME production. The disclosed processes generally function at higher temperatures with lower contact times and at lower pressures than conventional processes so as to produce higher DME yields than do conventional processes. Certain embodiments of the processes are carried out in reactors providing greater surface to volume ratios than the presently used DME reactors. Certain embodiments of the processes are carried out in systems comprising multiple microchannel reactors.

  8. Synthesis of dimethyl ether from methane mediated by HBr

    Institute of Scientific and Technical Information of China (English)

    Qin You; Zhen Liu; Wensheng Li; Xiaoping Zhou

    2009-01-01

    Dimethyl ether (DME) was synthesized from methane through a two-step process,in which CH_3 Br was prepared from the oxidative bromination reaction of methane in the presence of HBr and oxygen over a Rh-SiO_2 catalyst and then,in the second step,CH_3Br was hydrolyzed to DME over a silica supported metal chloride catalyst. 12 mol%ZnCl_2/SiO_2 catalyst was found to be the most active,but it deactivated because of Cl- losing.

  9. An aging study of wire chambers with dimethyl ether

    Energy Technology Data Exchange (ETDEWEB)

    Jibaly, M.; Chrusch, P. Jr.; Hilgenberg, G.; Majewski, S.; Wojcik, R.; Sauli, F.; Gaudaen, J.

    1989-02-01

    The authors report results on the aging of different types of resistive and non-resistive wires in wire chambers filled with dimethyl ether (DME) of varying degrees of purity. Among the Freon impurities detected in our DME batches, only Freon-11 was found to contribute to the aging process. Of the resistive wires, Nicotin and Stablohm produced fast aging, whereas stainless steel withstood extended irradiation in purified DME (up to 1 C/cm) without any apparent damage. Gold-plated tungsten and molybdenum wires produced results comparable to those of the stainless steel.

  10. Density measurements of compressed-liquid dimethyl ether + pentane mixtures.

    Science.gov (United States)

    Outcalt, Stephanie L; Lemmon, Eric W

    2016-01-01

    Compressed-liquid densities of three compositions of the binary mixture dimethyl ether (CAS No. 115-10-6) + pentane (CAS No. 109-66-0) have been measured with a vibrating U-tube densimeter. Measurements were made at temperatures from 270 K to 390 K with pressures from 1.0 MPa to 50 MPa. The overall combined uncertainty (k=2) of the density data is 0.81 kg·m(-3). Data presented here have been used to improve a previously formulated Helmholtz energy based mixture model. The newly derived parameters are given.

  11. Thermodynamics of Hydrogen Production from Dimethyl Ether Steam Reforming and Hydrolysis

    Energy Technology Data Exchange (ETDEWEB)

    T.A. Semelsberger

    2004-10-01

    The thermodynamic analyses of producing a hydrogen-rich fuel-cell feed from the process of dimethyl ether (DME) steam reforming were investigated as a function of steam-to-carbon ratio (0-4), temperature (100 C-600 C), pressure (1-5 atm), and product species: acetylene, ethanol, methanol, ethylene, methyl-ethyl ether, formaldehyde, formic acid, acetone, n-propanol, ethane and isopropyl alcohol. Results of the thermodynamic processing of dimethyl ether with steam indicate the complete conversion of dimethyl ether to hydrogen, carbon monoxide and carbon dioxide for temperatures greater than 200 C and steam-to-carbon ratios greater than 1.25 at atmospheric pressure (P = 1 atm). Increasing the operating pressure was observed to shift the equilibrium toward the reactants; increasing the pressure from 1 atm to 5 atm decreased the conversion of dimethyl ether from 99.5% to 76.2%. The order of thermodynamically stable products in decreasing mole fraction was methane, ethane, isopropyl alcohol, acetone, n-propanol, ethylene, ethanol, methyl-ethyl ether and methanol--formaldehyde, formic acid, and acetylene were not observed. The optimal processing conditions for dimethyl ether steam reforming occurred at a steam-to-carbon ratio of 1.5, a pressure of 1 atm, and a temperature of 200 C. Modeling the thermodynamics of dimethyl ether hydrolysis (with methanol as the only product considered), the equilibrium conversion of dimethyl ether is limited. The equilibrium conversion was observed to increase with temperature and steam-to-carbon ratio, resulting in a maximum dimethyl ether conversion of approximately 68% at a steam-to-carbon ratio of 4.5 and a processing temperature of 600 C. Thermodynamically, dimethyl ether processed with steam can produce hydrogen-rich fuel-cell feeds--with hydrogen concentrations exceeding 70%. This substantiates dimethyl ether as a viable source of hydrogen for PEM fuel cells.

  12. Low-Temperature Oxidation of Dimethyl Ether to Polyoxymethylene Dimethyl Ethers over CNT-Supported Rhenium Catalyst

    Directory of Open Access Journals (Sweden)

    Qingde Zhang

    2016-03-01

    Full Text Available Due to its excellent conductivity, good thermal stability and large specific surface area, carbon nano-tubes (CNTs were selected as support to prepare a Re-based catalyst for dimethyl ether (DME direct oxidation to polyoxymethylene dimethyl ethers (DMMx. The catalyst performance was tested in a continuous flow type fixed-bed reactor. H3PW12O40 (PW12 was used to modify Re/CNTs to improve its activity and selectivity. The effects of PW12 content, reaction temperature, gas hourly space velocity (GHSV and reaction time on DME oxidation to DMMx were investigated. The results showed that modification of CNT-supported Re with 30% PW12 significantly increased the selectivity of DMM and DMM2 up to 59.0% from 6.6% with a DME conversion of 8.9%; besides that, there was no COx production observed in the reaction under the optimum conditions of 513 K and 1800 h−1. The techniques of XRD, BET, NH3-TPD, H2-TPR, XPS, TEM and SEM were used to characterize the structure, surface properties and morphology of the catalysts. The optimum amount of weak acid sites and redox sites promotes the synthesis of DMM and DMM2 from DME direct oxidation.

  13. Hydrogen Production with Steam Reforming of Dimethyl Ether

    Institute of Scientific and Technical Information of China (English)

    Kaoru TAKEISHI; Akane ARASE

    2005-01-01

    @@ 1Introduction Steam reforming of methanol and gasoline is actively researched and developed as hydrogen supply methods for the fuel cells of vehicles and so on. However, these materials have the problems such as the infrastructure, toxicity, difficulty of the reforming, and so forth. Dimethyl ether (DME) does not contain the poisonous substances, and is expected as a clean fuel of the next generation. DME is able to take the place of light oil and LPG, and its physical properties are similar to those of LPG. There is possibility that DME infrastructures will be settled more rapidly than those of hydrogen and methanol, because LPG infrastructures existing are able to use for DME. Then, we have been studying on steam reforming of DME for the hydrogen production.

  14. Homogeneous Charge Compression Ignition Combustion of Dimethyl Ether

    DEFF Research Database (Denmark)

    Pedersen, Troels Dyhr

    This thesis is based on experimental and numerical studies on the use of dimethyl ether (DME) in the homogeneous charge compression ignition (HCCI) combustion process. The first paper in this thesis was published in 2007 and describes HCCI combustion of pure DME in a small diesel engine. The tests...... a substantial combustion delay in HCCI operation with DME to achieve post TDC combustion. By adding methanol to the inlet port during HCCI combustion of DME, the engine reached 50 percent of its full DI CI load capability without engine knock at 1000 rpm and somewhat less at 1800 rpm. The engine also had EGR...... were designed to investigate the effect of engine speed, compression ratio and equivalence ratio on the combustion timing and the engine performance. It was found that the required compression ratio depended on the equivalence ratio used. A lower equivalence ratio requires a higher compression ratio...

  15. Tiny pollutant emissions of a dimethyl ether fuelled engine

    Institute of Scientific and Technical Information of China (English)

    LANG Jing; ZHANG Yu-sheng; ZHOU Xiao-song; WU Hong-wei

    2008-01-01

    Emissions of dimethyl ether (DME) fuelled engines were investigated by orthogonal experiments on a ZS195 diesel engine. The study mainly focused on the tiny pollutant emissions of formaldehyde (CH2O), methyl formate (CH3OCHO) and formic acid (HCOOH). The presence of CH2O, CH3OCHO and HCOOH are proved in the exhaust by gas chromatograph and Fourier transform infrared spectroscopy. The analysis of variance results indicate that the fuel delivery advance angle is the most important factor for CH2O emission. The fuel delivery advance angle and the interaction of injection pressure and nozzle diameter are considerable factors for unburned hydrocarbon (UHC) emission. The mechanism forming tiny pollutants, primarily through CH2O formation, is suggested to be similar to the mechanism forming UHC by DME partial oxidation existing in crevices and boundary zones, and is verified via DME combustion simulation of a multizone chemical kinetic model.

  16. Identification of oxygenated ions in premixed flames of dimethyl ether and oxygen

    DEFF Research Database (Denmark)

    Frøsig Østergaard, L.; Egsgaard, H.; Hammerum, S.

    2003-01-01

    dimethyl ether, (CH3)(2)OH+. The flame-ion m/z 61 is a mixture of the trimethyloxonium ion, (CH3)(3)O+ and lesser amounts of protonated methyl formate and/or protonated ethyl methyl ether. The viability of an ionic mechanism to soot formation for dimethyl ether-oxygen flames is discussed on the background......The structure of characteristic flame-ions in premixed flames of dimethyl ether and oxygen was studied by ion-molecule reactions with ammonia and collision activation with argon. The results obtained show that the flame-ions m/z 45 and m/z 47 are the methoxymethyl cation, CH3OCH2+, and protonated...... of ions present in the dimethyl ether flames and the reactivity of the ions....

  17. Rate parameters for the reaction of atomic hydrogen with dimethyl ether and dimethyl sulfide

    Science.gov (United States)

    Lee, J. H.; Machen, R. C.; Nava, D. F.; Stief, L. J.

    1981-03-01

    Absolute rate constants for the reaction of atomic hydrogen with dimethyl ether (DME) and dimethyl sulfide (DMS) were obtained using the flash photolysis-resonance fluorescence technique. Under conditions where secondary reactions are avoided, rate constants for the H+DME reaction over the temperature range 273-426 K are well represented by the Arrhenius expression k1=(4.38±0.59)×10-12 exp(-1956±43/T) cm3 molecule-1 s-1. The corresponding Arrhenius expression for the H+DMS reaction over the temperature range 212-500 K is k2=(1.30±0.43)×10-11exp(-1118±81/T) cm3 molecule-1 s-1. The Arrhenius plot for k2 shows signs of curvature, however, and separate Arrhenius expressions are derived for the data above and below room temperature. These results are discussed and comparisons are made with previous determinations which employed flow discharge and product analysis techniques.

  18. Hydrogen production from dimethyl ether using corona discharge plasma

    Science.gov (United States)

    Zou, Ji-Jun; Zhang, Yue-Ping; Liu, Chang-Jun

    Dimethyl ether (DME), with its non-toxic character, high H/C ratio and high-energy volumetric density, is an ideal resource for hydrogen production. In this work, hydrogen production from the decomposition of DME using corona discharge has been studied. The corona discharge plasma decomposition was conducted at ambient conditions. The effects of dilution gas (argon), flow rate, frequency and waveforms on the DME decomposition were investigated. The addition of dilution gas can significantly increase the hydrogen production rate. The highest hydrogen production rate with the lowest energy consumption presents at the flow rate of 27.5 Nml min -1. AC voltage is more favored than DC voltage for the production of hydrogen with less energy input. The optimal frequency is 2.0 kHz. The hydrogen production rate is also affected by the input waveform and decreases as following: sinusoid triangular > sinusoid > ramp > square, whereas the sinusoid waveform shows the highest energy efficiency. The corona discharge decomposition of DME is leading to a simple, easy and convenient hydrogen production with no needs of catalyst and external heating.

  19. Experimental Research on Flash Boiling Spray of Dimethyl Ether

    Institute of Scientific and Technical Information of China (English)

    Peng Zhang

    2014-01-01

    The high-speed digital imaging technique is applied to observe the developing process of flash boiling spray of dimethyl ether at low ambient pressure, and the effects of nozzle opening pressure and nozzle hole diameter on the spray shape, spray tip penetration and spray angle during the injection are investigated. The experimental results show that the time when the vortex ring structure of flash boiling spray forms and its developing process are determined by the combined action of the bubble growth and breakup in the spray and the air drag on the leading end of spray;with the enhancement of nozzle opening pressure, the spray tip penetration increases and the spray angle decreases. The influence of nozzle hole diameter on the spray tip penetration is relatively complicated, the spray tip penetration is longer with a smaller nozzle hole diameter at the early stage of injection, while the situation is just opposite at the later stage of injection. This paper establishes that the variation of spray angle is consistent with that of nozzle hole diameter.

  20. Experimental research on flash boiling spray of dimethyl ether

    Science.gov (United States)

    Zhang, Peng

    2014-12-01

    The high-speed digital imaging technique is applied to observe the developing process of flash boiling spray of dimethyl ether at low ambient pressure, and the effects of nozzle opening pressure and nozzle hole diameter on the spray shape, spray tip penetration and spray angle during the injection are investigated. The experimental results show that the time when the vortex ring structure of flash boiling spray forms and its developing process are determined by the combined action of the bubble growth and breakup in the spray and the air drag on the leading end of spray; with the enhancement of nozzle opening pressure, the spray tip penetration increases and the spray angle decreases. The influence of nozzle hole diameter on the spray tip penetration is relatively complicated, the spray tip penetration is longer with a smaller nozzle hole diameter at the early stage of injection, while the situation is just opposite at the later stage of injection. This paper establishes that the variation of spray angle is consistent with that of nozzle hole diameter.

  1. Monte Carlo predictions of phase equilibria and structure for dimethyl ether + sulfur dioxide and dimethyl ether + carbon dioxide.

    Science.gov (United States)

    Kamath, Ganesh; Ketko, MaryBeth; Baker, Gary A; Potoff, Jeffrey J

    2012-01-28

    A new force field for dimethyl ether (DME) based on the Lennard-Jones (LJ) 12-6 plus point charge functional form is presented in this work. This force field reproduces experimental saturated liquid and vapor densities, vapor pressures, heats of vaporization, and critical properties to within the statistical uncertainty of the combined experimental and simulation measurements for temperatures between the normal boiling and critical point. Critical parameters and normal boiling point are predicted to within 0.1% of experiment. This force field is used in grand canonical histogram reweighting Monte Carlo simulations to predict the pressure composition diagrams for the binary mixtures DME + SO(2) at 363.15 K and DME + CO(2) at 335.15 and 308.15 K. For the DME + SO(2) mixture, simulation is able to qualitatively reproduce the minimum pressure azeotropy observed experimentally for this mixture, but quantitative errors exist, suggesting that multibody effects may be important in this system. For the DME + CO(2) mixture, simulation is able to predict the pressure-composition behavior within 1% of experimental data. Simulations in the isobaric-isothermal ensemble are used to determine the microstructure of DME + SO(2) and DME + CO(2) mixtures. The DME + SO(2) shows weak pairing between DME and SO(2) molecules, while no specific pairing or aggregation is observed for mixtures of DME + CO(2).

  2. Pra Desain Pabrik Dimethyl Ether (DME dari Gas Alam

    Directory of Open Access Journals (Sweden)

    Ajeng Puspitasari Yudiputri

    2014-09-01

    Full Text Available Berdasarkan data PT Pertamina (Persero, total konsumsi LPG 2008 mencapai 1,85 juta ton dan 600.000 ton di antaranya untuk program konversi. Pada 2009 kebutuhan LPG akan meningkat menjadi 3,67 juta ton dan 2 juta ton di antaranya untuk program konversi sampai akhir tahun. Namun, sumber pasokan LPG dari dalam negeri diperkirakan tidak akan beranjak dari angka 1,8 juta ton per tahun dalam beberapa tahun mendatang. Sehingga, Indonesia harus menutup kebutuhan dengan mengimpor LPG dalam jumlah cukup besar. Maka dari itu dibutuhkan bahan bakar gas lain yang mampu mengatasi permasalahan yang ditimbulkan tersebut. Dimethyl Ether (DME merupakan senyawa ether yang paling sederhana dengan rumus kimia CH3OCH3. Produksi DME dapat dihasilkan melalui sintesis gas alam. DME berbentuk gas yang tidak berwarna pada suhu ambien, zat kimia yang stabil, dengan titik didih -25,1oC. Tekanan uap DME sekitar 0,6 Mpa pada 25oC dan dapat dicairkan seperti halnya LPG. Viskositas DME 0,12-0,15 kg/ms, setara dengan viskositas propana dan butane (konstituen utama LPG, sehingga infrastruktur untuk LPG dapat juga digunakan untuk DME. Berdasarkan data Departemen ESDM pada Januari 2012, total cadangan gas alam Indonesia tercatat mencapai 150,70 Trillion Square Cubic Feet (TSCF. Berdasarkan jumlah tersebut, sebanyak 103,35 TSCF merupakan gas alam terbukti, sementara 47,35 TSCF sisanya masih belum terbukti. Berdasarkan hal tersebut, diketahui bahwa senyawa DME merupakan senyawa yang sesuai untuk bahan substitusi LPG. Dan ditinjau dari analisa ekonomi, didapatkan besar Investasi : $ 636,447,074.69 ; Internal Rate of Return\t: 20.51%; POT: 4.13 tahun; BEP : 37.36 %; dan NPV 10 year : $ 518,848,692. Dari ketiga parameter sensitifitas yaitu fluktuasi biaya investasi, harga bahan baku, dan harga jual dari produk, terlihat bahwa ketiganya tidak memberikan pengaruh yang cukup signifikan terhadap kenaikan atau penurunan nilai IRR pabrik. Sehingga pabrik DME dari Gas Alam ini layak untuk

  3. Dimethyl ether oxidation at elevated temperatures (295-600 K).

    Science.gov (United States)

    Rosado-Reyes, Claudette M; Francisco, Joseph S; Szente, Joseph J; Maricq, M Matti; Frøsig Østergaard, Lars

    2005-12-08

    Dimethyl ether (DME) has been proposed for use as an alternative fuel or additive in diesel engines and as a potential fuel in solid oxide fuel cells. The oxidation chemistry of DME is a key element in understanding its role in these applications. The reaction between methoxymethyl radicals and O(2) has been examined over the temperature range 295-600 K and at pressures of 20-200 Torr. This reaction has two product pathways. The first produces methoxymethyl peroxy radicals, while the second produces OH radicals and formaldehyde molecules. Real-time kinetic measurements are made by transient infrared spectroscopy to monitor the yield of three main products-formaldehyde, methyl formate, and formic acid-to determine the branching ratio for the CH(3)OCH(2) + O(2) reaction pathways. The temperature and pressure dependence of this reaction is described by a Lindemann and Arrhenius mechanism. The branching ratio is described by f = 1/(1 + A(T)[M]), where A(T) = (1.6(+2.4)(-1.0) x 10(-20)) exp((1800 +/- 400)/T) cm(3) molecule(-1). The temperature dependent rate constant of the methoxymethyl peroxy radical self-reaction is calculated from the kinetics of the formaldehyde and methyl formate product yields, k(4) = (3.0 +/- 2.1) x 10(-13) exp((700 +/- 250)/T) cm(3) molecule(-1) s(-1). The experimental and kinetics modeling results support a strong preference for the thermal decomposition of alkoxy radicals versus their reaction with O(2) under our laboratory conditions. These characteristics of DME oxidation with respect to temperature and pressure might provide insight into optimizing solid oxide fuel cell operating conditions with DME in the presence of O(2) to maximize power outputs.

  4. Torsionally Excited Dimethyl Ether in the Laboratory and in Space

    Science.gov (United States)

    Endres, C. P.; Müller, H. S. P.; Lewen, F.; Giesen, T. F.; Schlemmer, S.; Drouin, B. J.; Bisschop, S.; Groner, P.

    2010-06-01

    Dimethyl ether (DME) is highly abundant in hot cores and numerous transitions within the vibrational ground state have been detected in various interstellar line surveys of sources such as Orion KL. As a nearly prolate asymmetric top with two internal rotors, it shows a complex spectrum with low lying torsional modes. The energy levels of the two lowest torsional states (v11, and v15) lie only 200 and 240 cm-1 above the ground state (barrier height ≈ 915 cm-1), and are thus sufficiently populated in these interstellar sources to exhibit transitions in line surveys due to high excitation temperatures in hot cores. So far, the lack of sufficiently accurate predictions for the two lowest excited torsional states prevented their identification in astronomical spectra. Therefore, we analyzed spectra, which have been recorded within the context of the investigations of the ground state. In total, more than 9500 transitions have been assigned covering the frequency range from 38 up to 1670 GHz. The enlarged splitting of each rotational level into four substates (AA, EE, AE, EA) compared to its size in the ground state and a large number of perturbed transitions hampered not only the line assignment but also the astrophysical modelling. However, the inclusion of interaction terms between both excited states in the model of an effective Hamiltonian for a symmetric two-top rotor, allowed us to model both excited states within a global fit, and also to accurately determine the energy difference between both states. Frequency predictions have been calculated based on this analysis and have been used to unambiguously assign numerous rotational transitions within these excited states in the astronomical line survey of the hot core region G327.3-0.6. P. Schilke, T.D. Groesbeck et al., Astrophys.J.Suppl.Ser., 108,(1997) 301-337 P. Schilke, D.J. Benford, T.R. Hunter et al., Astrophys.J.Suppl.Ser., 132,(2001) 281-364. P. Groner, S. Albert, E. Herbst, and F.C. De Lucia, Astrophys

  5. Reaction mechanism of dimethyl ether carbonylation to methyl acetate over mordenite

    DEFF Research Database (Denmark)

    Rasmussen, Dominik Bjørn; Christensen, Jakob Munkholt; Temel, B.

    2017-01-01

    The reaction mechanism of dimethyl ether carbonylation to methyl acetate over mordenite was studied theoretically with periodic density functional theory calculations including dispersion forces and experimentally in a fixed bed flow reactor at pressures between 10 and 100 bar, dimethyl ether...... concentrations in CO between 0.2 and 2.0%, and at a temperature of 438 K. The theoretical study showed that the reaction of CO with surface methyl groups, the rate-limiting step, is faster in the eight-membered side pockets than in the twelve-membered main channel of the zeolite; the subsequent reaction...... of dimethyl ether with surface acetyl to form methyl acetate was demonstrated to occur with low energy barriers in both the side pockets and in the main channel. The present analysis has thus identified a path, where the entire reaction occurs favourably on a single site within the side pocket, in good...

  6. Conversion from Dimethyl Ether to Dimethoxymethane and Dimethoxyethane Using Dielectric-Barrier Discharge Plasma

    Institute of Scientific and Technical Information of China (English)

    Wang Yu; Liu Changjun; Zhang Yueping

    2005-01-01

    Experimental investigation was conducted to convert dimethyl ether (DME) in thepresence of steam using dielectric barrier discharge (DBD) at atmospheric pressure and 373 K.The flow rate of DME was 20 ml/min. The introduction of steam resulted in an increase in theDME conversion and the selectivity of oxygenates. Plasma steam-enhanced dimethyl ether (DME)conversion led to a direct synthesis of DMMT and DMET, with a high selectivity of 5.78% and17.99%, respectively. The addition of steam promoted the formation of "plasma aerosol" that wasfavored for the formation of liquid oxygenates. The reaction pathway of plasma DME conversionwas proposed.

  7. High-Temperature Shock Tube Measurements of Dimethyl Ether Decomposition and the Reaction of Dimethyl Ether with OH

    Science.gov (United States)

    Cook, Robert D.; Davidson, David F.; Hanson, Ronald K.

    2009-08-01

    We measured the first high-temperature rate measurements of two dimethyl ether (DME) reactions, (1) DME + Ar → CH3O + CH3 + Ar and (2) DME + OH → CH3OCH2 + H2O, in a shock tube by monitoring OH radicals. OH was measured with a narrow-line width laser absorption diagnostic using the well-known R1(5) line of the A-X(0,0) transition at 306.7 nm. The rate k1 is in the falloff regime at high temperatures, so it was measured at several pressures from 0.6 to 11.5 atm and temperatures from 1349 to 1790 K. OH radicals were formed by shock-heating mixtures of DME and O2 in Ar. These mixtures take advantage of the rapid decomposition of the product CH3O, forming H-atoms, which react with O2 to form OH. In carefully chosen mixtures, OH concentration is primarily sensitive to k1 and the well-known rate of H + O2 → OH + O. Uncertainty in the k1 measurements was estimated to be ±35%. The rate measurements were then modeled using RRKM theory, which describes the data quite well. Both the rate measurements and the RRKM model were fit from 1000 to 1800 K using the Troe falloff form: k1,∞(T) = (4.38 × 1021)T-1.57 exp(-42 220 K/T) s-1, k1,o = 7.52 × 1015 exp(-21 537 K/T) cm3 mol-1 s-1, and Fcent = 0.454 exp(-T/2510). The rate of k2 was measured at pressures near 1.6 atm and temperatures from 923 to 1423 K. OH radicals were generated by the thermal decomposition of the OH precursor tert-butyl hydroperoxide (TBHP), and k2 was inferred from the observed decay of OH with an estimated uncertainty of ±40%. The high-temperature measurements were compared with several rate evaluations and previous low-temperature measurements. The rate evaluation by Curran et al. of k2 = (6.32 × 106)T2 exp(328 K/T) (cm3 mol-1 s-1) was found to be an excellent fit to both the previous low-temperature measurements and this work.

  8. High-temperature shock tube measurements of dimethyl ether decomposition and the reaction of dimethyl ether with OH.

    Science.gov (United States)

    Cook, Robert D; Davidson, David F; Hanson, Ronald K

    2009-09-17

    We measured the first high-temperature rate measurements of two dimethyl ether (DME) reactions, (1) DME + Ar --> CH3O + CH3 + Ar and (2) DME + OH --> CH3OCH2 + H2O, in a shock tube by monitoring OH radicals. OH was measured with a narrow-line width laser absorption diagnostic using the well-known R1(5) line of the A-X(0,0) transition at 306.7 nm. The rate k1 is in the falloff regime at high temperatures, so it was measured at several pressures from 0.6 to 11.5 atm and temperatures from 1349 to 1790 K. OH radicals were formed by shock-heating mixtures of DME and O2 in Ar. These mixtures take advantage of the rapid decomposition of the product CH3O, forming H-atoms, which react with O2 to form OH. In carefully chosen mixtures, OH concentration is primarily sensitive to k1 and the well-known rate of H + O2 --> OH + O. Uncertainty in the k1 measurements was estimated to be +/-35%. The rate measurements were then modeled using RRKM theory, which describes the data quite well. Both the rate measurements and the RRKM model were fit from 1000 to 1800 K using the Troe falloff form: k(1,infinity)(T) = (4.38 x 10(21))T(-1.57) exp(-42,220 K/T) s(-1), k(1,o) = 7.52 x 10(15) exp(-21,537 K/T) cm3 mol(-1) s(-1), and F(cent) = 0.454 exp(-T/2510). The rate of k2 was measured at pressures near 1.6 atm and temperatures from 923 to 1423 K. OH radicals were generated by the thermal decomposition of the OH precursor tert-butyl hydroperoxide (TBHP), and k2 was inferred from the observed decay of OH with an estimated uncertainty of +/-40%. The high-temperature measurements were compared with several rate evaluations and previous low-temperature measurements. The rate evaluation by Curran et al. of k2 = (6.32 x 10(6))T2 exp(328 K/T) (cm3 mol(-1) s(-1)) was found to be an excellent fit to both the previous low-temperature measurements and this work.

  9. Global assessment of Dimethyl-ether as an automotive fuel (second edition)

    NARCIS (Netherlands)

    Verbeek, R.P.; Doorn, A. van; Walwijk, M. van

    1996-01-01

    This report studies the feasibility of dimethyl-ether (DME) as an automotive fuel. The report is aimed at putting DME in a wide perspective. Subjects included are production of the fuel, emissions, engine design, market introduction, safety and the possible position of DME in the future world-wide e

  10. Global assessment of Dimethyl-ether as an automotive fuel (second edition)

    OpenAIRE

    Verbeek, R.P.; Van Doorn, A.; Walwijk, M. van

    1996-01-01

    This report studies the feasibility of dimethyl-ether (DME) as an automotive fuel. The report is aimed at putting DME in a wide perspective. Subjects included are production of the fuel, emissions, engine design, market introduction, safety and the possible position of DME in the future world-wide energy supply. DME properties; DME production

  11. On-board conversion of methanol to dimethyl ether as an alternative diesel fuel

    Energy Technology Data Exchange (ETDEWEB)

    Armbruster, H.; Heinzelmann, G.; Struis, R.; Stucki, S. [Paul Scherrer Inst. (PSI), Villigen (Switzerland)

    1999-08-01

    The catalytic dehydration of methanol to dimethyl ether was investigated for application on-board a methanol fuelled vehicle. Several catalysts have been tested in a fixed bed reactor. Our approach is to develop a small and efficient reactor converting liquid MeOH under pressure and at low reaction temperatures. (author) 2 figs., 5 refs.

  12. Catalytic performance of hierarchical H-ZSM-5/MCM-41 for methanol dehydration to dimethyl ether

    Institute of Scientific and Technical Information of China (English)

    Yu; Sang; Hongxiao; Liu; Shichao; He; Hansheng; Li; Qingze; Jiao; Qin; Wu; Kening; Sun

    2013-01-01

    Micro-mesoporous composite molecular sieves H-ZSM-5/MCM-41 were prepared by the hydrothermal technique with alkali-treated H-ZSM-5zeolite as the source and characterized by scanning electron microscopy,transmission electron microscopy,energy dispersive spectroscopy,X-ray diffraction,N2 adsorption-desorption measurement and NH3 temperature-programmed desorption.The catalytic performances for the methanol dehydration to dimethyl ether over H-ZSM-5/MCM-41 were evaluated.Among these catalysts,H-ZSM-5/MCM-41 prepared with NaOH dosage (nNa/nSi) varying from 0.4 to 0.47 presented excellent catalytic activity with more than 80%methanol conversion and 100%dimethyl ether selectivity in a wide temperature range of 170—300℃,and H-ZSM-5/MCM-41 prepared with nNa/nSi=0.47 showed constant methanol conversion of about 88.7%,100% dimethyl ether selectivity and excellent lifetime at 220℃.The excellent catalytic performances were due to the highly active and uniform acidic sites and the hierarchical porosity in the micro-mesoporous composite molecular sieves.The catalytic mechanism of H-ZSM-5/MCM-41 for the methanol dehydration to dimethyl ether process was also discussed.

  13. Dimethyl Ether (DME) Assessment of Viscosity Using the New Volatile Fuel Viscometer (VFVM)

    DEFF Research Database (Denmark)

    Sivebæk, Ion Marius; Sorenson, Spencer C; Jakobsen, J.

    2001-01-01

    This paper describes the development and test of a viscometer capable of handling dimethyl Ether (DME) and other volatile fuels. DME has excellent combustion characteristics in diesel engines but the injection equipment can break down prematurely due to extensive wear when handling this fuel. It ...

  14. Ketene as a Reaction Intermediate in the Carbonylation of Dimethyl Ether to Methyl Acetate over Mordenite

    DEFF Research Database (Denmark)

    Rasmussen, Dominik Bjørn; Christensen, Jakob Munkholt; Temel, Burcin

    2015-01-01

    Unprecedented insight into the carbonylation of dimethyl ether over Mordenite is provided through the identification of ketene (CH2CO) as a reaction intermediate. The formation of ketene is predicted by detailed DFT calculations and verified experimentally by the observation of doubly deuterated ...

  15. Ketene as a Reaction Intermediate in the Carbonylation of Dimethyl Ether to Methyl Acetate over Mordenite

    DEFF Research Database (Denmark)

    Rasmussen, Dominik Bjørn; Christensen, Jakob Munkholt; Temel, Burcin;

    2015-01-01

    Unprecedented insight into the carbonylation of dimethyl ether over Mordenite is provided through the identification of ketene (CH2CO) as a reaction intermediate. The formation of ketene is predicted by detailed DFT calculations and verified experimentally by the observation of doubly deuterated...

  16. The electrochemical oxidation of dimethyl disulfide-Anodic methylsulfanylation of phenols and aromatic ethers

    Energy Technology Data Exchange (ETDEWEB)

    Quang Tho Do [Laboratoire d' Electrochimie et Environnement, CEREA, Universite Catholique de l' Ouest, BP 10808, 49008 ANGERS Cedex 01 (France); Elothmani, Driss [Laboratoire GRAPPE, Ecole Superieure d' Agriculture d' Angers, BP 30748, 49007 ANGERS Cedex 01 (France); Simonet, Jacques [Laboratoire d' Electrochimie Moleculaire (UMR CNRS 6510), Universite de RENNES 1, 35042 RENNES Cedex (France); Guillanton, Georges Le [Laboratoire d' Electrochimie et Environnement, CEREA, Universite Catholique de l' Ouest, BP 10808, 49008 ANGERS Cedex 01 (France)]. E-mail: gleguill@uco.fr

    2005-08-30

    The electrochemical oxidation of dimethyl disulfide was investigated in acetonitrile and dichloromethane. The nature of the oxidation strongly depends on the nucleophilicity of the solvent. In acetonitrile a one-electron oxidation is observed and the consecutive species did not exhibit any reactivity towards aromatic compounds subject to electrophile substitution. On the contrary, the oxidation of dimethyl disulfide in methylene chloride afforded a two-electron process with the formation of a species consistent with CH{sub 3} -S{sup +}. Its reactivity towards phenols and aromatic ethers was confirmed and showed a selective monomethylsulfanylation in most of the cases.

  17. Improvement of Lifetime Using Transition Metal-Incorporated SAPO-34 Catalysts in Conversion of Dimethyl Ether to Light Olefins

    National Research Council Canada - National Science Library

    Kim, Hyo-Sub; Lee, Su-Gyung; Kim, Young-Ho; Lee, Dong-Hee; Lee, Jin-Bae; Park, Chu-Sik

    2013-01-01

    Transition metal (Mn, Fe, or Ni) incorporated SAPO-34 (MeAPSO-34) nanocatalysts were synthesized using a hydrothermal method to improve the catalytic lifetime in the conversion of dimethyl ether to light olefins (DTO...

  18. Assessment of anticancer effect of chlorin e6 dimethyl ether for photodynamic therapy

    Directory of Open Access Journals (Sweden)

    M. A. Kaplan

    2014-01-01

    Full Text Available Results of the study for anticancer efficacy of photodynamic therapy with chlorin e6 dimethyl ether for treatment of outbread rats with sarcoma M-1 are represented. The drug was given intravenously or intraperitonealy at a dose of 1.25 mg/kg body weight (light dose – 300 J/cm2 or 2,5 mg/kg body weight (light dose – 150 J/cm2. The spectrometry showed that maximal drug accumulation in tumor was in 2 h after intravenous injection or 3 h after intraperitoneal injection of photosensitizer, thus, sensitized tumors were irradiated according to these time intervals. Intraperitoneal injection of chlorin е6 dimethyl ether at a dose of 1.25 mg/kg body weight with treatment session in 3 h and light dose of 300 J/cm2 was the most effective (the complete response in animals – 86%.

  19. Modeling of Bubble Column Slurry Reactor for Dimethyl Ether Synthesis from Syngas

    Institute of Scientific and Technical Information of China (English)

    张海涛; 应卫勇; 房鼎业

    2005-01-01

    A mathematical model for a bubble column slurry reactor is presented for dimethyl ether synthesis from syngas. Methanol synthesis from carbon monoxide and carbon dioxide by hydrogenation and the methanol dehydration are considered as independent reactions, in which methanol, dimethyl ether and carbon dioxide are the key components. In this model, the gas phase is considered to be in plug flow and the liquid phase to be in partly back mixing with axial distribution of solid catalyst. The simulation results show that the axial dispersion of solid catalysts, the operational height of the slurry phase in the bubble column slurry reactor, and the reaction results are influenced by the reaction temperature and pressure, which are the basic data for the scale-up of reactor.

  20. ZERO-DIMENSIONAL MODEL OF A DIMETHYL ETHER (DME) PLANT BASED ON GASIFICATION OF TORREFIED BIOMASS

    OpenAIRE

    Clausen, Lasse Røngaard; Elmegaard, Brian; Houbak, Niels; Braun, Robert J.

    2009-01-01

    A model of a DME fuel production plant was designed and analyzed in Aspen Plus. The plant produces DME by catalytic conversion of a syngas generated by gasification of torrefied woody biomass. Torrefication is a mild pyrolysis process that takes place at 200-300°C. Torrefied biomass has properties similar to coal, which enables the use of commercially available coal gasification processing equipment. The DME plant model is integrated with a steam cycle that utilizes waste heat from the plant ...

  1. ZERO-DIMENSIONAL MODEL OF A DIMETHYL ETHER (DME) PLANT BASED ON GASIFICATION OF TORREFIED BIOMASS

    DEFF Research Database (Denmark)

    Clausen, Lasse Røngaard; Elmegaard, Brian; Houbak, Niels

    2009-01-01

    A model of a DME fuel production plant was designed and analyzed in Aspen Plus. The plant produces DME by catalytic conversion of a syngas generated by gasification of torrefied woody biomass. Torrefication is a mild pyrolysis process that takes place at 200-300°C. Torrefied biomass has properties...... % (LHV) from torrefied biomass to DME and 70 % (LHV) if the exported electricity is included. When accounting for raw, untreated biomass, the efficiency for DME production is reduced to about 60 %....

  2. Barrierless proton transfer across weak CH⋯O hydrogen bonds in dimethyl ether dimer

    Energy Technology Data Exchange (ETDEWEB)

    Yoder, Bruce L., E-mail: bruce.yoder@phys.chem.ethz.ch; West, Adam H. C.; Signorell, Ruth [Laboratory of Physical Chemistry, ETH Zürich, Zürich 8093 (Switzerland); Bravaya, Ksenia B. [Department of Chemistry, Boston University, Boston, Massachusetts 02215-2521 (United States); Bodi, Andras [Molecular Dynamics Group, Paul Scherrer Institut, Villigen 5232 (Switzerland); Sztáray, Bálint [Department of Chemistry, University of the Pacific, Stockton, California 95211 (United States)

    2015-03-21

    We present a combined computational and threshold photoelectron photoion coincidence study of two isotopologues of dimethyl ether, (DME − h{sub 6}){sub n} and (DME − d{sub 6}){sub n}n = 1 and 2, in the 9–14 eV photon energy range. Multiple isomers of neutral dimethyl ether dimer were considered, all of which may be present, and exhibited varying C–H⋯O interactions. Results from electronic structure calculations predict that all of them undergo barrierless proton transfer upon photoionization to the ground electronic state of the cation. In fact, all neutral isomers were found to relax to the same radical cation structure. The lowest energy dissociative photoionization channel of the dimer leads to CH{sub 3}OHCH{sub 3}{sup +} by the loss of CH{sub 2}OCH{sub 3} with a 0 K appearance energy of 9.71 ± 0.03 eV and 9.73 ± 0.03 eV for (DME − h{sub 6}){sub 2} and deuterated (DME − d{sub 6}){sub 2}, respectively. The ground state threshold photoelectron spectrum band of the dimethyl ether dimer is broad and exhibits no vibrational structure. Dimerization results in a 350 meV decrease of the valence band appearance energy, a 140 meV decrease of the band maximum, thus an almost twofold increase in the ground state band width, compared with DME − d{sub 6} monomer.

  3. Thermodynamics of the Single-Step Synthesis of Dimethyl Ether from Syngas

    Institute of Scientific and Technical Information of China (English)

    王志良; 王金福; 任飞; 韩明汉; 金涌

    2004-01-01

    A detailed thermodynamic analysis of single-step synthesis of dimethyl ether (DME) from syngas has been performed. From experiments and theoretical calculations, a suitable thermodynamic model based on Reid's thermodynamic data and the Soave-Redlich-Kwong equation of state was determined. Using this model, a careful analysis of direct synthesis of dimethyl ether from syngas was carried out. Reaction synergy in the synthesis can greatly improve CO conversion and DME yield. Lower temperatures and higher pressures favor higher CO conversion and DME yield. Compared to methanol synthesis, however, the temperature has a smaller effect on the reaction. The direct synthesis of dimethyl ether can exploit CO-rich syngas efficiently due to the maximum DME yield obtained at H2/(CO+CO2) mole ratio =1. A small amount of CO2 in the reactant mixture has little effect on the reaction. Under conditions of H2/(CO+CO2) feedstock, water in the system can improve the reaction performance.

  4. Numerical investigation on the effect of injection pressure on the internal flow characteristics for diethyl ether, dimethyl ether and diesel fuel injectors using CFD

    Directory of Open Access Journals (Sweden)

    Vijayakumar Thulasi

    2011-01-01

    Full Text Available The spray characteristics of the diesel fuel are greatly affected by the cavitation formed inside the injector due to the high pressure differential across the nozzle. Many researchers across the globe are exploring the potential of using diethyl ether and dimethyl ether as an alternate for diesel fuel to meet the strict emission norms. Due to the variation in the fuel properties the internal flow characteristics in injectors for ether fuels are expected to be different from that of the diesel fuel. In this paper computational technique is used to study and compare the internal flow characteristics of diethyl ether, dimethyl ether and diesel fuel. The two phase flow model considering the fuel as a mixture of liquid and vapor is adopted for the simulation study. The injection pressure is varied from 100 to 400 bar and the flow characteristics of all three fuels are simulated and compared. Results indicate that all three fuels have distinct cavitating patterns owing to different property values. The dimethyl ether is found to be more cavitating than diesel and diethyl ether fuels as expected. The mass of fuel injected are found to be decreasing for the ether fuels when compared with diesel fuel at all injection pressures.

  5. Adsorption and reactions of dimethyl and diethyl ethers on Mo 2C/Mo(1 0 0)

    Science.gov (United States)

    Farkas, A. P.; Solymosi, F.

    2008-04-01

    The adsorption, desorption and dissociation of dimethyl ether and diethyl ether on Mo 2C/Mo(1 0 0) have been investigated by work function, thermal desorption (TPD) and high resolution electron energy loss spectroscopy (HREELS). The adsorption of both molecules at 100 K caused a significant decrease in the work function of the Mo 2C/Mo(1 0 0) surface. In the case of dimethyl ether almost 90% of the adsorbed monolayer desorbed intact with a Tp = 286 K. Another part decomposed to CO ( Tp = 330 and 960 K) and H 2 ( Tp = 330 and 400 K). The desorption of diethyl ether at monolayer occurred with Tp = 256 and 340 K. Another fraction underwent decomposition as indicated by the release of CO ( Tp = 336 and 436 K) and H 2 ( Tp = 400 K). In addition, the formation of ethylene ( Tp = 342 K) and a very small amount of methane ( Tp = 380 K) was also observed. HREEL spectra of both ethers confirmed their molecular adsorption at 100 K. From the spectral changes occurred upon increasing the exposures and in off-specular direction some conclusions were drawn on the bonding of the adsorbed molecules. Analysis of the HREEL spectra of the annealed layers suggested that in the primary steps the adsorbed ethers dissociate to methyl and methoxy (dimethyl ether), and to ethyl and ethoxy (diethyl ether) species, which react further to yield the desorption products.

  6. Chapter 25 First-Principles Investigation of Dimethyl Ether Steam Reforming

    Science.gov (United States)

    Fukushima, Kimichika

    This paper reports the investigation of dimethyl ether (DME) steam reforming and related processes. The study uses the X[alpha] molecular orbital theory, which has been successfully applied to analyze material properties. It was found that, when H2O approaches Al on a surface of Si oxides (and pure Al2O3), charge transfer between H2O and the surface destabilizes the H2O. Approach of the destabilized H to a CH3OCH3 molecule then produces CH3OH. Finally, injection of CO2, by-produced in the reforming, to coal seam was shown to increase the CH4 production by substitution.

  7. Evaluation of Methyl Fluoride and Dimethyl Ether as Inhibitors of Aerobic Methane Oxidation

    OpenAIRE

    Oremland, Ronald S.; Culbertson, Charles W.

    1992-01-01

    Methyl fluoride (MF) and dimethyl ether (DME) were effective inhibitors of aerobic methanotrophy in a variety of soils. MF and DME blocked consumption of CH4 as well as the oxidation of 14CH4 to 14CO2, but neither MF nor DME affected the oxidation of [14C]methanol or [14C]formate to 14CO2. Cooxidation of ethane and propane by methane-oxidizing soils was also inhibited by MF. Nitrification (ammonia oxidation) in soils was inhibited by both MF and DME. Production of N2O via nitrification was in...

  8. Modified Two-Step Dimethyl Ether (DME) Synthesis Simulation from Indonesian Brown Coal

    OpenAIRE

    Dwiwahju Sasongko; Abdurrahman Fadhlil Halim Luthan; Winny Wulandari

    2016-01-01

    A theoretical study was conducted to investigate the performance of dimethyl ether (DME) synthesis from coal. This paper presents a model for two-step DME synthesis from brown coal represented by the following processes: drying, gasification, water-gas reaction, acid gas removal, and DME synthesis reactions. The results of the simulation suggest that a feedstock ratio of coal : oxygen : steam of 1 : 0.13 : 0.821 produces the highest DME concentration. The water-gas reactor simulation at a tem...

  9. Some results on the ageing of wire chambers with dimethyl ether

    Energy Technology Data Exchange (ETDEWEB)

    Jibaly, M.; Chrusch, P. Jr.; Hilgenberg, G.; Majewski, S.; Wojcik, R.; Weintraub, R.; Sauli, F.

    1988-12-01

    Ageing results of three test wire detectors when filled with dimethyl ether (DME) are presented. DME gas was analyzed before and during the tests for the presence of electronegative impurities, such as Freons. A strong dependence of the rate of ageing on the wire composition was observed. The resistive wires, such as Stablohm and Nicotin, produced fast ageing. Also, even the best available purified DME, as of today, used with gold-plated wires, produced some slow ageing. The rate of amplitude decrease depended on the Freon impurity level.

  10. [Determination of dimethyl ether correction factors in gas chromatography with TCD and FID].

    Science.gov (United States)

    Chen, J; Zhang, L; Yang, L; Cai, G

    1997-05-01

    Dimethyl ether (DME) correction factors in gas chromatography with thermal conductivity detector (TCD) and flame ionization detector (FID) by using H2 as carrier gas were determined in this work. The homemade DME gas was quantitatively absorbed in ice-cold water. With ethanol as standard, the aqueous mixture was injected into a gas chromatograph, equipped with serially-connected TCD and FID. The weight correction factors of DME based on methanol were 0.86 and 0.55 for TCD and FID respectively. The result for TCD was also confirmed by calculation based on the stoichiometrical transformation of methanol into DME in reaction gas chromatography.

  11. Cooperative hydrophobic/hydrophilic interactions in the hydration of dimethyl ether.

    Science.gov (United States)

    Utiramerur, S; Paulaitis, M E

    2010-04-21

    Cooperative interactions in the hydration of dimethyl ether (DME) relative to its purely hydrophobic analog, propane, are analyzed by expressing the free energy of hydration in terms of an "inner-shell" contribution from water molecular packing and chemical association, and an "outer-shell" contribution described by the mean binding energy of the solute to the solution and fluctuations in this binding energy. We find that nonadditive, cooperative interactions associated with strong correlations in the binding energy fluctuations of the methyl groups and ether oxygen play a dominant role in the hydration of DME relative to propane. The electrostatic nature of these interactions is revealed in a multi-Gaussian analysis of hydration substates, which shows that the formation of favorable ether oxygen-water hydrogen bonds is correlated with less favorable methyl group-water interactions, and vice versa. We conclude that the group additive distinction between the hydrophobic hydration of the DME methyl groups and hydrophilic hydration of the ether oxygen is lost in the context of these cooperative interactions. Our results also suggest that the binding energy fluctuations of constituent hydrophobic/hydrophilic groups are more sensitive than local water density fluctuations for characterizing the hydration of heterogeneous interfaces.

  12. Fourier Transform Microwave Spectroscopic Studies of Dimethyl Ether and Ethylene Flames

    Science.gov (United States)

    Obenchain, Daniel A.; Wullenkord, Julia; Kohse-Höinghaus, Katharina; Grabow, Jens-Uwe; Hansen, Nils

    2017-06-01

    Microwave spectroscopy has been a proven technique for the detection of short-lived molecules produced from a variety of molecular sources. With the goal of observing more reactive intermediates produced in combustion reactions, the products of a home-built flat flame burner were measured on a coaxially oriented beam resonator arrangement (COBRA) Fourier transform microwave spectrometer. The products are coupled into a molecular beam using a fast-mixing nozzle styled after the work of Gutowsky and co-workers. Probing the flame at various positions, the relative abundance of products can be observed as a function of flame depth. One dimensional intensity profiles are available for formaldehyde, ketene, acetaldehyde, and dimethyl ether, where either a dimethyl ether fuel or an ethylene fuel was burned in the presence of oxygen. The current arrangement allows only for stable species produced in the flame to be observed in the molecular beam. This combination of species source and detection shows promise for future work in observing new, short-lived, combustion intermediates. J.-U. Grabow, W. Stahl, H. Dreizler, Rev. Sci. Instrum. 67, 4072, 1996 T. Emilsson, T. D. Klots, R. S. Ruoff, H.S. Gutowsky, J. Chem. Phys. 93, 6971, 1990

  13. Fuel from biomass residues via dimethyl ether; Kraftstoff aus Restbiomasse via Dimethylether

    Energy Technology Data Exchange (ETDEWEB)

    Otto, Thomas N.; Dahmen, Nicolaus; Neumann-Walter, Doreen [Karlsruher Institut fuer Technologie (KIT), Eggenstein-Leopoldshafen (Germany); Wang, Li Ju [National Taiwan Univ., Taipei (China). Dept. of Chemical Engineering

    2010-07-01

    In the Seventies of last century, the MTG process (methanol to gasoline) was developed as an alternative to the Fischer-Tropsch process of the Thirties. In the FT process, synthesis gas is converted strictly into hydrocarbons while the MTG process uses dimethyl ether (DME) as an intermediate. Synthesis via DME using zeolite catalysts has advantages in terms of reaction heat, yield, selectivity, reactor design, and process conditions. This fact led to the development of the DTG process (dimethyl ether to gasoline) first described by Lee et al., which has become the most relevant process for conversion of DME from biomass to gasoline. Conversion of biomass to gasoline is one of the several process stages of the bioliq {sup registered} process developed at KIT, in which motor fuels and chemical feedstocks are to be produced from dry biomass. As it is the catalyst that makes the molecule, catalysts with long operating times will be developed, analyzed and characterized, tested and optimized on a laboratory scale. For this, several types of zeolites will be produced and will be combined with various transition elements using appropriate processes (sol-gel process etc.).

  14. A Preliminary Study Of The Effect Of Some Pressurising Gasses On The Viscosity Of Dimethyl Ether

    DEFF Research Database (Denmark)

    Sivebæk, Ion Marius

    2006-01-01

    Dimethyl Ether (DME) has been recognised as a clean substitute for diesel oil as it does not form soot during combustion. DME has a vapour pressure of 6 bar at 25 C so pressurisation is necessary to keep DME liquid at ambient temperature. Inert gases are good candidates as pressurising media...... for DME but their effect on DME viscosity is unknown. Argon (Ar), nitrogen (N2), carbon dioxide (CO2), hydrogen (H2) and Propane (C3H8) have been investigated at pressure levels of 12 – 15 bars. A Cannon-Manning semi-micro capillary glass viscometer, size 25, enclosed in a cylindrical pressure container......-micro glass viscometers, size 25, submerged completely in a constant temperature bath. A kinematic viscosity of 0,188 cSt  0,001 cSt @ 25 C, was found, consistent with the previous and initial result 0,186 cSt   0,002 cSt. Key words: Dimethyl Ether (DME), a clean substitute for diesel oil. DME viscosity...

  15. Catalyst activity maintenance study for the liquid phase dimethyl ether process

    Energy Technology Data Exchange (ETDEWEB)

    Peng, X.D.; Toseland, B.A.; Underwood, R.P. [Air Products and Chemicals, Inc., Allentown, PA (United States)

    1995-12-31

    The co-production of dimethyl ether (DME) and methanol from syngas is a process of considerable commercial attractiveness. DME coproduction can double the productivity of a LPMEOH process when using coal-derived syngas. This in itself may offer chemical producers and power companies increased flexibility and more profitable operation. DME is also known as a clean burning liquid fuel; Amoco and Haldor-Topsoe have recently announced the use of DME as an alternative diesel fuel. Moreover, DME can be an interesting intermediate in the production of chemicals such as olefins and vinyl acetate. The current APCl liquid phase dimethyl ether (LPDME) process utilizes a physical mixture of a commercial methanol synthesis catalyst and a dehydration catalyst (e.g., {gamma}-alumina). While this arrangement provides a synergy that results in much higher syngas conversion per pass compared to the methanol-only process, the stability of the catalyst system suffers. The present project is aimed at reducing catalyst deactivation both by understanding the cause(s) of catalyst deactivation and by developing modified catalyst systems. This paper describes the current understanding of the deactivation mechanism.

  16. Performance of ultrasonic – Treated nano-zeolites employed in the preparation of dimethyl ether

    Directory of Open Access Journals (Sweden)

    Sanaa M. Solyman

    2013-06-01

    Full Text Available Catalytic dehydration of methanol to dimethyl ether was carried out over nano-zeolites and their modified samples via ultrasonic technique. Parent H-Beta and Parent H-Mordenite zeolites are used as synthesized and after sonication. H-Mordenite sonicated for 20 and 120 min whereas H-Beta sonicated for 20 min only. The reaction temperature was varied between 100 and 225 °C at three different contact times. The different catalyst samples were characterized using: XRD, FTIR, TEM, SEM and NH3-TPD techniques. The results revealed that sonication of parent zeolite samples affects on the unit cell dimensions and their crystal size. FTIR-spectroscopic analysis indicated that sonication may decrease the pore opening and cause framework structure defects. TEM and SEM micrographs showed that sonication broke-up and re-ordered zeolite crystals with longer time resulted in a different morphology relative to parents and also change the particle size. Sonicated samples have a good performance in methanol dehydration with complete conversion and complete selectivity to dimethyl ether at lower temperature relative to the corresponding parent zeolites. TPD results indicated that the concentration of strong acid sites decreased in sonicated H-Mordenite samples leading to an increase of their catalytic activity and the selectivity to DME. On the other hand, ultrasonic treatment of H-Beta sample decreased its catalytic activity.

  17. Thermodynamic analysis of small-scale dimethyl ether (DME) and methanol plants based on the efficient two-stage gasifier

    DEFF Research Database (Denmark)

    Clausen, Lasse Røngaard; Elmegaard, Brian; Ahrenfeldt, Jesper;

    2011-01-01

    Models of dimethyl ether (DME) and methanol synthesis plants have been designed by combining the features of the simulation tools DNA and Aspen Plus. The plants produce DME or methanol by catalytic conversion of a syngas generated by gasification of woody biomass. Electricity is co-produced in th......Models of dimethyl ether (DME) and methanol synthesis plants have been designed by combining the features of the simulation tools DNA and Aspen Plus. The plants produce DME or methanol by catalytic conversion of a syngas generated by gasification of woody biomass. Electricity is co...

  18. Mathematical Modeling for the Development of Equipment for Thermochemical Processing of Wood Waste in to Dimethyl Ether

    Science.gov (United States)

    Sadrtdinov, Almaz R.; Esmagilova, Liliya M.; Saldaev, Vladimir A.; Sattarova, Zulfiya G.; Mokhovikov, Alexey A.

    2016-08-01

    The paper describes the process of thermochemical wood waste processing in to dimethyl ether. The physical picture of the process of waste wood recycling was compiled and studied and the mathematical model in the form of differential and algebraic equations with initial and boundary conditions was developed on its basis. The mathematical model allows to determine the optimum operating parameters of synthesis gas producing process, suitable for the catalytic synthesis of dimethyl ether and to calculate the basic constructive parameters of the equipment flowsheet.

  19. Enhanced catalytic performance of zeolite ZSM-5 for conversion of methanol to dimethyl ether by combining alkaline treatment and partial activation

    NARCIS (Netherlands)

    Wei, Ying; de Jongh, Petra E.; Bonati, Matteo L. M.; Law, David J.; Sunley, Glenn J.; de Jong, Krijn P.

    2015-01-01

    Zeolite ZSM-5 (MFI) due to its excellent hydrothermal stability and high catalytic activity for methanol dehydration to dimethyl ether (MID) has been considered for use in combination with a methanol synthesis catalyst, such as Cu/ZnO/Al2O3, in the conversion of syngas to dimethyl ether. However, th

  20. Enhanced catalytic performance of zeolite ZSM-5 for conversion of methanol to dimethyl ether by combining alkaline treatment and partial activation

    NARCIS (Netherlands)

    Wei, Ying; de Jongh, Petra E.|info:eu-repo/dai/nl/186125372; Bonati, Matteo L. M.; Law, David J.; Sunley, Glenn J.; de Jong, Krijn P.|info:eu-repo/dai/nl/06885580X

    2015-01-01

    Zeolite ZSM-5 (MFI) due to its excellent hydrothermal stability and high catalytic activity for methanol dehydration to dimethyl ether (MID) has been considered for use in combination with a methanol synthesis catalyst, such as Cu/ZnO/Al2O3, in the conversion of syngas to dimethyl ether. However,

  1. Short and stereoselective total synthesis of furano lignans (+/-)-dihydrosesamin, (+/-)-lariciresinol dimethyl ether, (+/-)-acuminatin methyl ether, (+/-)-sanshodiol methyl ether, (+/-)-lariciresinol, (+/-)-acuminatin, and (+/-)-lariciresinol monomethyl ether and furofuran lignans (+/-)-sesamin, (+/-)-eudesmin, (+/-)-piperitol methyl ether, (+/-)-pinoresinol, (+/-)-piperitol, and (+/-)-pinoresinol monomethyl ether by radical cyclization of epoxides using a transition-metal radical source.

    Science.gov (United States)

    Roy, Subhas Chandra; Rana, Kalyan Kumar; Guin, Chandrani

    2002-05-17

    Intramolecular radical cyclization of suitably substituted epoxy ethers 4a-g using bis(cyclopentadienyl)titanium(III) chloride as the radical source resulted in trisubstituted tetrahydrofurano lignans and 2,6-diaryl-3,7-dioxabicyclo[3.3.0]octane lignans depending on the reaction conditions. The titanium(III) species was prepared in situ from commercially available titanocene dichloride and activated zinc dust in THF. Upon radical cyclization followed by acidic workup, epoxy olefinic ethers 4a-g afforded furano lignans dihydrosesamin 1a, lariciresinol dimethyl ether 1b, acuminatin methyl ether 1e, and sanshodiol methyl ether 1g directly and lariciresinol 1h, acuminatin 1i, and lariciresinol monomethyl ether 1j after removal of the benzyl protecting group by controlled hydrogenolysis of the corresponding cyclized products. The furofuran lignans sesamin 2a, eudesmin 2b, and piperitol methyl ether 2e were also prepared directly by using the same precursors 4a-f on radical cyclization followed by treatment with iodine and pinoresinol 2h, piperitol 2i, and pinoresinol monomethyl ether 2j after controlled hydrogenolysis of the benzyl protecting group of the corresponding cyclized products. Two naturally occurring acyclic lignans, secoisolariciresinol 5h and secoisolariciresinol dimethyl ether 5b, have also been prepared by exhaustive hydrogenolysis of 2h and 2b, respectively.

  2. Synthesis and characterisation of telechelic poly(2,6-dimethyl-1,4-phenylene ether) for copolymerisation

    NARCIS (Netherlands)

    Krijgsman, J.; Feijen, J.; Gaymans, R.J.

    2003-01-01

    Telechelic poly(2,6-dimethyl-1,4-phenylene ether) (PPE) segments are interesting starting materials, for example for copolymerisation. A good method to make partly bifunctional PPE-2OH is by redistribution or depolymerisation of high molecular weight commercial PPE with tetramethyl bisphenol A. The

  3. 直接二甲醚燃料电池%Direct Dimethyl-ether Fuel Cell

    Institute of Scientific and Technical Information of China (English)

    邵玉艳; 尹鸽平; 高云智; 史鹏飞

    2004-01-01

      在分析现有氢氧燃料电池和直接甲醇燃料电池存在的问题的基础上,介绍了一种新型燃料电池棗直接二甲醚燃料电池的特点及其研究现状,还分析了直接二甲醚燃料电池的发展前景以及对于中国能源安全和可持续发展的意义。%  On the basis analyzing the existing problems of proton exchange membrane fuel cell (PEMFC) and direct methanol fuel cell (DMFC), a new fuel cell, Direct dimethyl-ether fuel cell (DDFC), was introduced. The prospect of the development of DDFC and its significance to energy security in China and sustainable development were also analyzed.

  4. Evaluation of methyl fluoride and dimethyl ether as inhibitors of aerobic methane oxidation

    Science.gov (United States)

    Oremland, R.S.; Culbertson, C.W.

    1992-01-01

    Methyl fluoride (MF) and dimethyl ether (DME) were effective inhibitors of aerobic methanotrophy in a variety of soils. MF and DME blocked consumption of CH4 as well as the oxidation of 14CH4 to 14CO2, but neither MF nor DME affected the oxidation of [14C]methanol or [14C]formate to 14CO2. Cooxidation of ethane and propane by methane-oxidizing soils was also inhibited by MF. Nitrification (ammonia oxidation) in soils was inhibited by both MF and DME. Production of N2O via nitrification was inhibited by MF; however, MF did not affect N2O production associated with denitrification. Methanogenesis was partially inhibited by MF but not by DME. Methane oxidation was ~100-fold more sensitive to MF than was methanogenesis, indicating that an optimum concentration could be employed to selectively block methanotrophy. MF inhibited methane oxidation by cell suspensions of Methylococcus capsulatus; however, DME was a much less effective inhibitor.

  5. Thermodynamic analysis of carbon formation boundary and reforming performance for steam reforming of dimethyl ether

    Science.gov (United States)

    Faungnawakij, Kajornsak; Kikuchi, Ryuji; Eguchi, Koichi

    Thermodynamic analysis of dimethyl ether steam reforming (DME SR) was investigated for carbon formation boundary, DME conversion, and hydrogen yield for fuel cell application. The equilibrium calculation employing Gibbs free minimization was performed to figure out the required steam-to-carbon ratio (S/C = 0-5) and reforming temperature (25-1000 °C) where coke formation was thermodynamically unfavorable. S/C, reforming temperature and product species strongly contributed to the coke formation and product composition. When chemical species DME, methanol, CO 2, CO, H 2, H 2O and coke were considered, complete conversion of DME and hydrogen yield above 78% without coke formation were achieved at the normal operating temperatures of molten carbonate fuel cell (600 °C) and solid oxide fuel cell (900 °C), when S/C was at or above 2.5. When CH 4 was favorable, production of coke and that of hydrogen were significantly suppressed.

  6. Steam Reforming of Dimethyl Ether by Gliding Arc Gas Discharge Plasma for Hydrogen Production

    Institute of Scientific and Technical Information of China (English)

    王保伟; 孙启梅; 吕一军; 杨美琳; 闫文娟

    2014-01-01

    Gliding arc gas discharge plasma was used for the generation of hydrogen from steam reforming of di-methyl ether (DME). A systemic procedure was employed to determine the suitable experimental conditions. It was found that DME conversion first increased up to the maximum and then decreased slightly with the increase of added water and air. The increase of total feed gas flow rate resulted in the decrease of DME conversion and hy-drogen yield, but hydrogen energy consumption dropped down to the lowest as total feed gas flow rate increased to 76 ml·min-1. Larger electrode gap and higher discharge voltage were advantageous. Electrode shape had an impor-tant effect on the conversion of DME and production of H2. Among the five electrodes, electrode 2# with valid length of 55 mm and the radian of 34 degrees of the top electrode section was the best option, which enhanced ob-viously the conversion of DME.

  7. On-board fuel conversion: Dimethyl ether from methanol for compression ignition engines

    Energy Technology Data Exchange (ETDEWEB)

    Armbruster, H.; Stucki, S.

    2002-03-01

    One example of an on-board fuel conversion system is the fumigation of dimethyl ether. In this concept, a fraction of the methanol used as fuel is catalytically converted on-board to DME and water. The rate-determining step of the catalytic reaction with {gamma}-Al{sub 2}O{sub 3} as a catalyst is found to be the reaction of adsorbed intermediates; mass transfer is limited by Knudsen diffusivity. Providing DME for fumigation in a 180 kW engine will require approx. 0,7 kg of catalyst. The transient behavior of a pilot fixed-bed reactor has been estimated using simplified models, which show that the cold start should be manageable in less than one minute. This is an acceptable time for cold-starting an engine in heavy-duty vehicles. (author)

  8. Assessment of Lubricity Properties of Dimethyl Ether Using the Medium Frequency Reciprocating Rig

    DEFF Research Database (Denmark)

    Sivebæk, Ion Marius; Sorenson, Spencer C

    2001-01-01

    Adequate lubricity of a fuel is an important issue when the wear in diesel engine injection equipment is to be minimised. For conventional diesel oils, there exist methods capable of measuring the lubricity of the fuels. These methods cannot handle Dimethyl Ether (DME), as it has to be pressurised....... The calibration was achieved by using both the standard method for diesel oil and the MFPRR, to test three liquid fuels of varying lubricities. The result was that the MFPRR discriminated just as well between the fuel lubricities as did the standard method. The lubricity of DME was measured and was found...... exceptionally low. By mixing the DME with very small quantities of additives the lubricity can be redressed. Only one additive was capable of giving DME a lubricity higher than the one of diesel oil. Even at such high lubricities it cannot be concluded that wear in the diesel injection pumps...

  9. Efficient Synthesis of Dimethyl Ether from Methanol in a Bifunctional Zeolite Membrane Reactor.

    Science.gov (United States)

    Zhou, Chen; Wang, Nanyi; Qian, Yanan; Liu, Xiaoxing; Caro, Jürgen; Huang, Aisheng

    2016-10-04

    A sandwich FAU-LTA zeolite dual-layer membrane has been developed and used as a catalytic membrane reactor for the synthesis of dimethyl ether (DME). In the top H-FAU layer with mild acidity, methanol is dehydrated to DME. The other reaction product, water, is removed in situ through a hydrophilic Na-LTA layer, which is located between the porous alumina support and the H-FAU top layer. The combination of mild acidity with the continuous removal of water results in high methanol conversion (90.9 % at 310 °C) and essentially 100 % DME selectivity. Furthermore, owing to the selective and continuous removal of water through the Na-LTA membrane, catalyst deactivation can be effectively suppressed. © 2016 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  10. Selective and efficient synthesis of ethanol from dimethyl ether and syngas

    DEFF Research Database (Denmark)

    Rasmussen, Dominik Bjørn

    an important role as a gasoline additive or substitute and a catalytic process has been demonstrated, in which dimethyl ether (DME) produced from synthesis gas is converted to methyl acetate (MA), which is subsequently converted to EtOH and methanol (MeOH). MeOH can afterwards be easily converted to DME, using...... of Mordenite and that the reaction of CO with methyl groups is the rate limiting reaction step. Thus, in contrast to the previous DFT studies, the DFT model developed here is fully consistent the experimental results. An experimental study of the reaction kinetics has shown that MA inhibits the reaction....... A kinetic model, taking this effect into account, was developed and it could accurately describe the dependence of the reaction rates on the amount of catalyst and the partial pressures of the reactants. The product inhibition of the reaction rate makes it difficult to scale the process up, as 2 it sets...

  11. Wettability, optical properties and molecular structure of plasma polymerized diethylene glycol dimethyl ether

    Energy Technology Data Exchange (ETDEWEB)

    Azevedo, T C A M; Algatti, M A; Mota, R P; Honda, R Y; Kayama, M E; Kostov, K G; Fernandes, R S [FEG-DFQ-UNESP, Av. Ariberto Pereira da Cunha 333, 12516-410 - Guaratingueta, SP (Brazil); Cruz, N C; Rangel, E C, E-mail: algatti@feg.unesp.b [UNESP, Avenida Tres de Marco, 511, 18087-180 Sorocaba, SP (Brazil)

    2009-05-01

    Modern industry has frequently employed ethylene glycol ethers as monomers in plasma polymerization process to produce different types of coatings. In this work we used a stainless steel plasma reactor to grow thin polymeric films from low pressure RF excited plasma of diethylene glycol dimethyl ether. Plasmas were generated at 5W RF power in the range of 16 Pa to 60 Pa. The molecular structure of plasma polymerized films and their optical properties were analyzed by Fourier Transform Infrared Spectroscopy (FTIR) and Ultraviolet-Visible Spectroscopy, respectively. The IR spectra show C-H stretching at 3000-2900 cm{sup -1}, C=O stretching at 1730-1650 cm{sup -1}, C-H bending at 1440-1380 cm{sup -1}, C-O and C-O-C stretching at 1200-1000 cm{sup -1}. The refraction index was around 1.5 and the optical gap calculated from absorption coefficient presented value near 3.8 eV. Water contact angle of the films ranged from 40 deg. to 35 deg. with corresponding surface energy from 66 to 73x10{sup -7} J. Because of its favorable optical and hydrophilic characteristics these films can be used in ophthalmic industries as glass lenses coatings.

  12. Catalytic Oxidation of Dimethyl Ether to Dimethoxymethane over Cs Modified H3PW12O40/SiO2 Catalysts

    Institute of Scientific and Technical Information of China (English)

    Qingde Zhang; Yisheng Tan; Caihong Yang; Yizhuo Han; Jun Shamoto; Noritatsu Tsubaki

    2007-01-01

    The attractive utilization route for one-step catalytic oxidation of dimethyl ether to dimethoxymethane was successfully carried out over the H3PW12O40(40%)/SiO2 catalyst,modified by Cs,K,Ni,and V.The Cs modification of H3PW12040(40%)/SiO2 gave the most promising result of 20%dimethyl ether conversion and 34.8% dimethoxymethane selectivity.Dimethoxymethane could be synthesized via methoxy groups decomposed from dimethyl ether through the synergistic effect between the acid sites and the redox sites of Cs modified H3PW12040(40%)/SiO2.

  13. Simulation and model design of pipe-shell reactor for the direct synthesis of dimethyl ether from syngas

    Institute of Scientific and Technical Information of China (English)

    Yanfang Hu; Zhaoguang Nie; Dingye Fang

    2008-01-01

    The simulation was made based on the model of pipe-shell reactor that was established by the model of global kinetics of synthesis of dimethyl ether from syngas over a bifunctional catalyst. The results of simulation showed that the selectivity for dimethyl ether (DME) and the conversion of CO were higher but the hot spot was kept below the temperature limit of the pipe-shell reactor. The suitable diameter of the pipe was φ38e pipe was 5.8 m. The optimal process conditions of the reactor were that the pressure was 5 MPa, the temperature of the cooling water was 240 ℃, and the temperature of the raw gas at inlet of the reactor was 220 ℃. The production of this reactor was 102800 t/y (ton per year) under these conditions.

  14. Modeling and simulation of tube-shell reactor for dimethyl-ether synthesis from coal-based synthesis gas

    Institute of Scientific and Technical Information of China (English)

    CHEN Da-sheng; ZHANG Hai-tao; YING Wei-yong; FANG Ding-ye

    2011-01-01

    Mathematical simulation was performed on tube-shell reactor for dimethyl ether (DME) synthesis from coal-based syngas. The model was established based on kinetics of dimethyl-ether synthesis from syngas over a bifunctional catalyst,which is mixed by methanol synthesis catalyst and dehydration catalyst as 1:1 mass ratio. Methanol synthesis from CO and CO2 and methanol dehydration were selected as three-independent reactions, CO, CO2, and DME as key components to establish the one-dimensional mathematical model of the reactor. The gas concentration and temperature profiles inside the reactor tubes were obtained. The operating conditions affecting DME synthesis were also discussed based on the model. The simulations indicate that higher pressure and lower temperature at the inlet and rich hydrogen in the reactant are favorable in direct DME synthesis in fixed-bed process, and the temperature of boiling water affect the reactor performance seriously.

  15. Synthesis of Dimethyl Ether from CO Hydrogenation: a Thermodynamic Analysis of the Influence of Water Gas Shift Reaction

    Institute of Scientific and Technical Information of China (English)

    Guangxin Jia; Yisheng Tan; Yizhuo Han

    2005-01-01

    Three reactions involved in dimethyl ether (DME) synthesis from CO hydrogenation: methanol synthesis reaction (MSR), methanol dehydration reaction (MDR) and water gas shift reaction (WGSR) are studied by thermodynamic calculation. For demonstrating this process in detail, three models, MSR,MSR+MDR, MSR+MDR+WGSR, are used. Their basic characteristics can be obtained by varying widely the ratios of H2 to CO in the feed (no CO2). Through thermodynamic analysis a chemical synergic effect obviously exists in the second and third models. By comparison between two models it is found that WGSR plays a special role in dimethyl ether synthesis. It is possible for the two models to shift one to the other by regulating CO2 concentration in feed. For Model 2, the selectivity for DME in oxygenates (DME+methanol) does not change with the ratio of H2 to CO.

  16. Thermodynamic equilibrium calculations of hydrogen production from the combined processes of dimethyl ether steam reforming and partial oxidation

    Science.gov (United States)

    Semelsberger, Troy A.; Borup, Rodney L.

    Thermodynamic analyses of producing a hydrogen-rich fuel-cell feed from the combined processes of dimethyl ether (DME) partial oxidation and steam reforming were investigated as a function of oxygen-to-carbon ratio (0.00-2.80), steam-to-carbon ratio (0.00-4.00), temperature (100 °C-600 °C), pressure (1-5 atm) and product species. Thermodynamically, dimethyl ether processed with air and steam generates hydrogen-rich fuel-cell feeds; however, the hydrogen concentration is less than that for pure DME steam reforming. Results of the thermodynamic processing of dimethyl ether indicate the complete conversion of dimethyl ether to hydrogen, carbon monoxide and carbon dioxide for temperatures greater than 200 °C, oxygen-to-carbon ratios greater than 0.00 and steam-to-carbon ratios greater than 1.25 at atmospheric pressure (P = 1 atm). Increasing the operating pressure has negligible effects on the hydrogen content. Thermodynamically, dimethyl ether can produce concentrations of hydrogen and carbon monoxide of 52% and 2.2%, respectively, at a temperature of 300 °C, and oxygen-to-carbon ratio of 0.40, a pressure of 1 atm and a steam-to-carbon ratio of 1.50. The order of thermodynamically stable products (excluding H 2, CO, CO 2, DME, NH 3 and H 2O) in decreasing mole fraction is methane, ethane, isopropyl alcohol, acetone, n-propanol, ethylene, ethanol and methyl-ethyl ether; trace amounts of formaldehyde, formic acid and methanol are observed. Ammonia and hydrogen cyanide are also thermodynamically favored products. Ammonia is favored at low temperatures in the range of oxygen-to-carbon ratios of 0.40-2.50 regardless of the steam-to-carbon ratio employed. The maximum ammonia content (i.e., 40%) occurs at an oxygen-to-carbon ratio of 0.40, a steam-to-carbon ratio of 1.00 and a temperature of 100 °C. Hydrogen cyanide is favored at high temperatures and low oxygen-to-carbon ratios with a maximum of 3.18% occurring at an oxygen-to-carbon ratio of 0.40 and a steam

  17. Energy-Saving Lipid Extraction from Wet Euglena gracilis by the Low-Boiling-Point Solvent Dimethyl Ether

    Directory of Open Access Journals (Sweden)

    Hideki Kanda

    2015-01-01

    Full Text Available We tested a wet extraction method for lipid extraction from Euglena gracilis water slurry at 0.51 MPa and 20 °C using liquefied dimethyl ether (DME. The yields, proximate analyses, elemental composition, and molecular weight distribution properties of the extracts from E. gracilis and the remaining residues obtained by DME extraction were compared with those of the extracts obtained by hexane Soxhlet extraction.

  18. (Vapour + liquid) equilibria of the {l_brace}pentafluoroethane (HFC-125) + dimethyl ether (DME){r_brace} system

    Energy Technology Data Exchange (ETDEWEB)

    Im, Jihoon [School of Chemical and Biological Engineering and Institute of Chemical Processes, Seoul National University, Shinlim-dong, Gwanak-gu, Seoul 151-744 (Korea, Republic of); Lee, Gangwon [School of Chemical and Biological Engineering and Institute of Chemical Processes, Seoul National University, Shinlim-dong, Gwanak-gu, Seoul 151-744 (Korea, Republic of); Lee, Jongcheon [LG Chem, Ltd. Research Park, Yuseong-gu, Science Town, Daejeon 305-380 (Korea, Republic of); Kim, Hwayong [School of Chemical and Biological Engineering and Institute of Chemical Processes, Seoul National University, Shinlim-dong, Gwanak-gu, Seoul 151-744 (Korea, Republic of)]. E-mail: hwayongk@snu.ac.kr

    2006-12-15

    Binary (vapour + liquid) equilibrium data were measured for the {l_brace}pentafluoroethane (HFC-125) + dimethyl ether (DME){r_brace} system at temperatures from (313.15 to 363.15) K. These experiments were carried out with a circulating-type apparatus with on-line gas chromatography. The experimental data were correlated well by the Peng-Robinson Stryjek-Vera equation of state using the Wong-Sandler mixing rules.

  19. Combining activated carbon adsorption with heterogeneous photocatalytic oxidation: lack of synergy for biologically treated greywater and tetraethylene glycol dimethyl ether.

    Science.gov (United States)

    Gulyas, Holger; Argáez, Angel Santiago Oria; Kong, Fanzhuo; Jorge, Carlos Liriano; Eggers, Susanne; Otterpohl, Ralf

    2013-01-01

    The aim of the study was to evaluate whether the addition of activated carbon in the photocatalytic oxidation of biologically pretreated greywater and of a polar aliphatic compound gives synergy, as previously demonstrated with phenol. Photocatalytic oxidation kinetics were recorded with fivefold concentrated biologically pretreated greywater and with aqueous tetraethylene glycol dimethyl ether solutions using a UV lamp and the photocatalyst TiO2 P25 in the presence and the absence of powdered activated carbon. The synergy factor, SF, was quantified as the ratio of photocatalytic oxidation rate constant in the presence of powdered activated carbon to the rate constant without activated carbon. No synergy was observed for the greywater concentrate (SF approximately 1). For the aliphatic compound, tetraethylene glycol dimethyl ether, addition of activated carbon actually had an inhibiting effect on photocatalysis (SF photocatalytic oxidation of tetraethylene glycol dimethyl ether by addition of powdered activated carbon was attributed to shading of the photocatalyst by the activated carbon particles. It was assumed that synergy in the hybrid process was limited to aromatic organics. Regardless of the lack of synergy in the case of biologically pretreated greywater, the addition of powdered activated carbon is advantageous since, due to additional adsorptive removal of organics, photocatalytic oxidation resulted in a 60% lower organic concentration when activated carbon was present after the same UV irradiation time.

  20. Mesoporous silica materials modified with alumina polycations as catalysts for the synthesis of dimethyl ether from methanol

    Energy Technology Data Exchange (ETDEWEB)

    Macina, Daniel; Piwowarska, Zofia; Tarach, Karolina; Góra-Marek, Kinga [Jagiellonian University, Faculty of Chemistry, Ingardena 3, 30-060 Kraków (Poland); Ryczkowski, Janusz [Maria Curie Skłodowska University, Faculty of Chemistry, Maria Curie-Skłodowska 2, 20-031 Lublin (Poland); Chmielarz, Lucjan, E-mail: chmielar@chemia.uj.edu.pl [Jagiellonian University, Faculty of Chemistry, Ingardena 3, 30-060 Kraków (Poland)

    2016-02-15

    Highlights: • Deposition of alumina ologoctaions on mesoporous silicas modified with surface −SO{sub 3}H groups. • Alumina aggregates generated acid properties in the silica supports. • Alumina modified SBA-15 and MCF were active and selective catalysts in DME synthesis. - Abstract: Mesoporous silica materials (SBA-15 and MCF) were used as catalytic supports for the deposition of aggregated alumina species using the method consisting of the following steps: (i) anchoring 3-(mercaptopropyl)trimethoxysilane (MPTMS) on the silica surface followed by (ii) oxidation of −SH to−SO{sub 3}H groups and then (iii) deposition of aluminum Keggin oligocations by ion-exchange method and (iv) calcination. The obtained samples were tested as catalysts for synthesis of dimethyl ether from methanol. The modified silicas were characterized with respect to the ordering of their porous structure (XRD), textural properties (BET), chemical composition (EDS, CHNS), structure ({sup 27}Al NMR, FTIR) and location of alumina species (EDX-TEM), surface acidity (NH{sub 3}-TPD, Py-FTIR) and thermal stability (TGA). The obtained materials were found to be active and selective catalysts for methanol dehydration to dimethyl ether (DME) in the MTD process (methanol-to-dimethyl ether).

  1. Intrinsic Kinetics of Dimethyl Ether Synthesis from Plasma Activation of CO2 Hydrogenation over Cu-Fe-Ce/HZSM-5.

    Science.gov (United States)

    Su, Tongming; Zhou, Xinhui; Qin, Zuzeng; Ji, Hongbing

    2017-02-02

    CO2 is activated in a plasma reactor followed by hydrogenation over a Cu-Fe-Ce/HZSM-5 catalyst, and the intrinsic kinetics of the plasma catalytic process are studied. Compared with CO2 hydrogenation using Cu-Fe-Ce/HZSM-5 alone, the CO2 conversion and the dimethyl ether selectivity for the plasma catalytic process are increased by 16.3 %, and 10.1 %, respectively, indicating that the CO2 was activated by the plasma to promote hydrogenation. A study of the intrinsic kinetics shows that the activation energies of methanol formation, the reverse water-gas shift reaction, and methanol dehydration to dimethyl ether are 149.34, 75.47, and 73.18 kJ mol(-1) , respectively, which are lower than if Cu-Fe-Ce/HZSM-5 is used without plasma, indicating that the activation of CO2 in the plasma reduces the activation energy of the hydrogenation reaction and improves the yield of dimethyl ether.

  2. Simulation of a multi-stage adiabatic reactor with inter-stage quenching for dimethyl ether synthesis

    Directory of Open Access Journals (Sweden)

    Bai Ziyang

    2014-01-01

    Full Text Available Adiabatic fixed-bed reactor has proven commercially successful in large scale production of catalytic dehydration of methanol to dimethyl ether. A one dimensional pseudo-homogeneous model of an industrial reactor of dimethyl ether synthesis has been established. To verify the proposed model, the simulation results have been compared to available data from an industrial reactor. A good agreement has been found between them. The distribution of the catalyst bed temperature and concentration of each component was obtained under conditions of inlet temperature 260°C, reaction pressure 1.2MPa and gaseous hourly space velocity 950.7 h-1. With inlet catalyst bed temperature 240-280°C, operating pressure 0.6-1.8MPa and gaseous hourly space velocity 831.8-1069.5 h-1, the influence of these reaction conditions on temperature distribution of the reactor catalytic bed, outlet methanol conversion and the dimethyl ether yield were calculated. The results show that, with the rise of inlet temperature (240-280°C and operating pressure (0.6-1.8MPa, the outlet conversion of methanol, the hot spot temperature and the DME yield increased. The increase of gaseous hourly space velocity (831.8-1069.5 h-1 leads to a decrease in the hot spot temperature of catalytic bed and the outlet conversion of methanol. But the DME yield rise initially and then descend.

  3. Recovery of Bio-Oil from Industrial Food Waste by Liquefied Dimethyl Ether for Biodiesel Production

    Directory of Open Access Journals (Sweden)

    Kiyoshi Sakuragi

    2016-02-01

    Full Text Available The development of new energy sources has become particularly important from the perspective of energy security and environmental protection. Therefore, the utilization of waste resources such as industrial food wastes (IFWs in energy production is expected. The central research institute of electric power industry (CRIEPI, Tokyo, Japan has recently developed an energy-saving oil-extraction technique involving the use of liquefied dimethyl ether (DME, which is an environmentally friendly solvent. In this study, three common IFWs (spent coffee grounds, soybean, and rapeseed cakes were evaluated with respect to oil yield for biodiesel fuel (BDF production by the DME extraction method. The coffee grounds were found to contain 16.8% bio-oil, whereas the soybean and rapeseed cakes contained only approximately 0.97% and 2.6% bio-oil, respectively. The recovered oils were qualitatively analysed by gas chromatography-mass spectrometry. The properties of fatty acid methyl esters derived from coffee oil, such as kinematic viscosity, pour point, and higher heating value (HHV, were also determined. Coffee grounds had the highest oil content and could be used as biofuel. In addition, the robust oil extraction capability of DME indicates that it may be a favourable alternative to conventional oil extraction solvents.

  4. Development of a Nuclear Hydrogen Production System by Dimethyl Ether (DME) Steam Reforming and Related Technology

    Science.gov (United States)

    Fukushima, Kimichika; Oota, Hiroyuki; Yamada, Kazuya; Makino, Shinichi; Yagyu, Motoshige; Ikeda, Tatsumi; Asayama, Masahiro; Ogawa, Takashi; Yoshino, Masato

    Targeting a hydrogen production system using heat produced by a nuclear reactor at about 300°C, we are developing a dimethyl ether (DME) steam reformer and hydrogen purification systems as well as catalysts for DME reforming. The use of heat from a nuclear reactor suppresses the CO2 concentration change in the atmosphere. In our developments, a catalyst, consisting of mixed oxides, produced hydrogen at a rate of about 1.9 Nm3/h per catalyst volume (m3) at about 300°C. Subsequently, the DME steam reformer achieved a hydrogen production rate of approximately, at least, 1.4 Nm3/h at about 300°C, by absorbing heat from the supplied steam. The aforementioned hydrogen production system via DME steam reforming is to be demonstrated using a thermal power plant. DME steam reforming by using waste heat and the utilization of the produced hydrogen within a combined cycle power plant can reduce fuel consumption, for instance, by about 17% compared to the case of direct DME combustion. The total system, with the use of DME, was compared with the methane case. If necessary, the byproduced CO2 may be injected into coal seams, increasing CH4 production via the substitution of CO2 for CH4 on coal, where CO2 adsorption is expected to be stronger than the CH4 adsorption.

  5. Formation of Methanol and Dimethyl Ether in Dielectric Barrier Disch arges

    Science.gov (United States)

    Kogelschatz, Ulrich

    1996-10-01

    The generation of liquid fuels like methanol (MeOH) and dimethyl ether (DME) from the greenhouse gases (GHG) methane and carbon dioxide has recently attracted growing attention. Investigations of this kind are part of efforts to reduce GHG emissions to the atmosphere. For our investigations we used a tubular dielectric barrier discharge reactor with an annular discharge gap of 1 mm width and a cylindrical quartz dielectric of 2.5 mm thickness. It was operated in methane-oxygen mixtures at pressures between 1 and 4 bar. The discharge was operated at a frequency of about 18 kHz. The power density could be raised up to 20 kW/m^2 of electrode area by increasing the applied voltage. Up to 1.3% MeOH and .4% DME were measured after a single passage through a discharge gap of 310 mm length by GC and GC/MS detection. These values were obtained at 2 bar, substantially lower values were measured at 1 or 4 bar operating pressure. At high specific energies >8 eV per molecule of feed gas the MeOH concentration decreased and methyl formate appeared in the product stream.

  6. Process simulation of single-step dimethyl ether production via biomass gasification.

    Science.gov (United States)

    Ju, Fudong; Chen, Hanping; Ding, Xuejun; Yang, Haiping; Wang, Xianhua; Zhang, Shihong; Dai, Zhenghua

    2009-01-01

    In this study, we simulated the single-step process of dimethyl ether (DME) synthesis via biomass gasification using ASPEN Plus. The whole process comprised four parts: gasification, water gas shift reaction, gas purification, and single-step DME synthesis. We analyzed the influence of the oxygen/biomass and steam/biomass ratios on biomass gasification and synthesis performance. The syngas H(2)/CO ratio after water gas shift process was modulated to 1, and the syngas was then purified to remove H(2)S and CO(2), using the Rectisol process. Syngas still contained trace amounts of H(2)S and about 3% CO(2) after purification, which satisfied the synthesis demands. However, the high level of cold energy consumption was a problem during the purification process. The DME yield in this study was 0.37, assuming that the DME selectivity was 0.91 and that CO was totally converted. We performed environmental and economic analyses, and propose the development of a poly-generation process based on economic considerations.

  7. Modified Two-Step Dimethyl Ether (DME Synthesis Simulation from Indonesian Brown Coal

    Directory of Open Access Journals (Sweden)

    Dwiwahju Sasongko

    2016-08-01

    Full Text Available A theoretical study was conducted to investigate the performance of dimethyl ether (DME synthesis from coal. This paper presents a model for two-step DME synthesis from brown coal represented by the following processes: drying, gasification, water-gas reaction, acid gas removal, and DME synthesis reactions. The results of the simulation suggest that a feedstock ratio of coal : oxygen : steam of 1 : 0.13 : 0.821 produces the highest DME concentration. The water-gas reactor simulation at a temperature of 400°C and a pressure of 20 bar gave the ratio of H2/CO closest to 2, the optimal value for two-step DME synthesis. As for the DME synthesis reactor simulation, high pressure and low temperature promote a high DME concentration. It is predicted that a temperature of 300°C and a pressure of 140 bar are the optimum conditions for the DME synthesis reaction. This study also showed that the DME concentration produced by the two-step route is higher than that produced by one-step DME synthesis, implying that further improvement and research are needed to apply two-step DME synthesis to production of this liquid fuel.

  8. Partial oxidation of dimethyl ether to H2/syngas over supported Pt catalyst

    Institute of Scientific and Technical Information of China (English)

    Yazhong Chen; Zongping Shao; Nanping Xu

    2008-01-01

    Dimethyl ether (DME) is a non-toxic fuel with high H/C ratio and high volumetric energy density, and could be served as an ideal source of H2/syngas production for application in solid oxide fuel cells (SOFC). This study presents results of DME partial oxidation over a 1.5 wt% Pt/Ceo.4 Zro.6O2 catalyst under the condition of gas hourly space velocity (GHSV) of 15000-60000 ml/(gh), molar ratio of O2/DME of 0.5 and 500-700 ℃, and this temperature range was also the operation temperature range for intermediate temperature SOFC. The results indicated that the catalyst showed good activity for the selective partial oxidation of DME to H2/syngas. Under the working conditions investigated, DME was completely converted. Increase in reaction temperature enhanced the amount of syngas, but lowered the H2/CO ratio and yield of methane; while increase in reaction GHSV resulted in only slight variation in the distribution of products. The good catalytic activity of Pt supported on Ceo.4Zro.6O2 for the partial oxidation of DME may be directly associated with the good oxygen storage capacity of the support, which is worth of further investigation to develop materials for application in SOFC.

  9. Performance of modified H-ZSM-5 zeolite for dehydration of methanol to dimethyl ether

    Energy Technology Data Exchange (ETDEWEB)

    Hassanpour, Samaneh; Taghizadeh, Majid [Department of chemical engineering, Babol University of Technology, P.O. Box 484, 4714871167 Babol (Iran); Yaripour, Fereydoon [Catalyst Research Group, Petrochemical Research and Technology Company, National Petrochemical Company, Tehran (Iran)

    2010-10-15

    The conversion of methanol to dimethyl ether was carried out over various commercial zeolites and modified H-ZSM-5 catalysts to evaluate their catalytic performance. A series of commercially available zeolite samples were used for vapor-phase dehydration of methanol to DME. Catalyst screening tests were performed in a fixed-bed reactor under the same operating conditions (T = 300 S, P = 16 barg, WHSV = 3.8 h{sup -1}). It was found that all the H-form zeolite catalysts in this study were active and selective for DME synthesis. According to the experimental results MDHC-1 catalyst exhibited the highest activity in dehydration of methanol. After finding the most active catalyst, the H-MFI90 zeolite was modified with Na content varying from 0 to 120 mol%, via wet-impregnation method to further improve its selectivity. All of catalysts were characterized by BET, XRD, NH{sub 3}-TPD, ICP, TGA, SEM, FT-IR and TPH techniques. It was found that these materials affected activity of MDHC-1 zeolite by changing its acidity. Ultimately, among all the catalysts studied, Na{sub 100}-modified H-MFI90 zeolite exhibited optimum activity, selectivity and stability at methanol dehydration reaction. (author)

  10. The aging of wire chambers filled with dimethyl ether: Wire and construction materials and freon impurities

    Energy Technology Data Exchange (ETDEWEB)

    Jibaly, M.; Majewski, S.; Chrusch, P. Jr.; Wojcik, R. (Florida Univ., Gainesville (USA). Dept. of Physics (USA)); Sauli, F.; Gaudaen, J. (European Organization for Nuclear Research, Geneva (Switzerland). EP-Div. (Switzerland))

    1989-11-10

    This is a complete summary of our study of the aging of different types of wire chambers, with a variety of construction materials and wires, filled with dimethyl ether (DME) of varying degrees of purity. The resistive Nicotin and Stablohm wires were corroded by DME, producing fast aging. The moderately resistive stainless steel wires were able to withstand extended irradiation (up to 1 C/cm) in high-purity DME without any apparent damage; and gold-plated tungsten and molybdenum wires exhibited a comparable behavior. Many construction materials were tested and recommendations are thus reached as to what kinds of materials are safe in building DME-operated wire chambers. Among many different Freon and hydrocarbon impurities detected in DME by means of gas chromatography (GC), Freon-11 was found to be mostly responsible for the aging, even with noncorrosive stainless steel or gold-plated wires. The availability and feasibility of obtaining Freon-free DME is reported as well. (orig.).

  11. Electron momentum spectroscopy of dimethyl ether taking account of nuclear dynamics in the electronic ground state

    Energy Technology Data Exchange (ETDEWEB)

    Morini, Filippo; Deleuze, Michael Simon, E-mail: michael.deleuze@uhasselt.be [Center of Molecular and Materials Modelling, Hasselt University, Agoralaan Gebouw D, B-3590 Diepenbeek (Belgium); Watanabe, Noboru; Kojima, Masataka; Takahashi, Masahiko [Institute of Multidisciplinary Research for Advanced Materials, Tohoku University, Sendai 980-8577 (Japan)

    2015-10-07

    The influence of nuclear dynamics in the electronic ground state on the (e,2e) momentum profiles of dimethyl ether has been analyzed using the harmonic analytical quantum mechanical and Born-Oppenheimer molecular dynamics approaches. In spite of fundamental methodological differences, results obtained with both approaches consistently demonstrate that molecular vibrations in the electronic ground state have a most appreciable influence on the momentum profiles associated to the 2b{sub 1}, 6a{sub 1}, 4b{sub 2}, and 1a{sub 2} orbitals. Taking this influence into account considerably improves the agreement between theoretical and newly obtained experimental momentum profiles, with improved statistical accuracy. Both approaches point out in particular the most appreciable role which is played by a few specific molecular vibrations of A{sub 1}, B{sub 1}, and B{sub 2} symmetries, which correspond to C–H stretching and H–C–H bending modes. In line with the Herzberg-Teller principle, the influence of these molecular vibrations on the computed momentum profiles can be unraveled from considerations on the symmetry characteristics of orbitals and their energy spacing.

  12. Control of Ignition and Combustion of Dimethyl Ether in Homogeneous Charge Compression Ignition Engine

    Science.gov (United States)

    Kim, Kyoung-Oh; Azetsu, Akihiko; Oikawa, Chikashi

    A homogeneous charge compression ignition (HCCI) engine is known to have high thermal efficiency and low nitrogen oxide emission. However, the control of ignition timing and its combustion period over a wide range of engine speeds and loads is one of the barriers to the realization of the engine. On the lean side of the equivalence ratio, control of ignition is difficult due to its long delay of ignition, and there is knocklike problem under high load. In both computations and experiments of HCCI engine operated on dimethyl ether, the operable range (the possible range of fuel input from just ignitable to knock-occurring state) shifted to the rich side with decreasing intake temperature and amount of mixing of carbon dioxide. The range of fuel input was reduced at low intake temperatures, because the hot flame onset angle advanced more quickly than it did at high intake temperatures. However, the mixing of CO2 caused the operable range to shift to the rich side while retaining the same range. The results of this study indicated the possibility of high-load operation or extension of the load range by exhaust gas recirculation.

  13. Experimental Study on Dimethyl Ether Combustion Process in Homogeneous Charge Compression Ignition Mode

    Institute of Scientific and Technical Information of China (English)

    郑尊清; 史春涛; 尧命发

    2004-01-01

    Experimental study on homogeneous charge compression ignition (HCCI) combustion process was carried out on a single-cylinder direct injection diesel engine fueled with dimethyl ether(DME). The influence of inert gas CO2 on the ignition and combustion process was investigated. The research results indicate that because of the high cetane number of DME, the stable HCCI operating range is quite narrow while the engine has a high compression ratio. The HCCI operating range can be largely extended when the inert gas is inducted into the charging air. HCCI combustion of DME presents remarkable characteristic of two-stage combustion process. As the concentration of inert gas increases, the ignition timing of the first combustion stage delays, the peak heat release rate decreases, and the combustion duration extends. Inducting inert gas into charging air cannot make the combustion and heat release of DME occur at a perfect crank angle position. Therefore,to obtain HCCI operation for the fuel with high cetane number,other methods such as reducing engine compression ratio should be adopted. Emission results show that under HCCI operation, a nearly zero NOx emission can be obtained with no smoke emissions. But the HC and CO emissions are high, and both rise with the increase of the concentration of inert gases.

  14. Raman Spectra of Methane, Ethylene, Ethane, Dimethyl ether, Formaldehyde and Propane for Combustion Applications

    KAUST Repository

    Magnotti, G.

    2015-05-09

    Spontaneous Raman scattering measurements of temperature and major species concentration in hydrocarbon-air flames require detailed knowledge of the Raman spectra of the hydrocarbons present when fuels more complex than methane are used. Although hydrocarbon spectra have been extensively studied at room temperature, there are no data available at higher temperatures. Quantum mechanical calculations, when available are not sufficiently accurate for combustion applications. This work presents experimental measurements of spontaneous Stokes-Raman scattering spectra of methane, ethylene, ethane, dimethyl ether, formaldehyde and propane in the temperature range 300-860 K. Raman spectra from heated hydrocarbons jets have been collected with a higher resolution than is generally employed for Raman measurements in combustion applications. A set of synthetic spectra have been generated for each hydrocarbon, providing the basis for extrapolation to higher temperatures. The spectra provided here will enable simultaneous measurements of multiple hydrocarbons in flames. This capability will greatly extend the range of applicability of Raman measurements in combustion applications. In addition, the experimental spectra provide a validation dataset for quantum mechanical models.

  15. Formate species in the low-temperature oxidation of dimethyl ether.

    Science.gov (United States)

    Liu, I; Cant, N W; Bromly, J H; Barnes, F J; Nelson, P F; Haynes, B S

    2001-01-01

    The oxidation of dimethyl ether (DME, 340 ppm in 10% O2) has been studied experimentally in an atmospheric pressure laminar flow reactor in the temperature range from 240 degrees C to 700 degrees C for residence times in the range 2-4 s. The influence of nitric oxide additions up to 620 ppm to the feed gases has also been investigated. Products of reaction were determined by FTIR. In the absence of NO, reaction is first detected at about 260 degrees C. The products in the low-temperature region include formaldehyde (HCHO), and formic acid (HCOOH). The addition of NO leads to the appearance of methyl formate (CH3OCHO). While the overall behaviour of the system can be explained qualitatively in terms of typical low-temperature hydrocarbon ignition, recently published chemical kinetic models for DME ignition do not allow for the formation of these formate species. We find no experimental evidence for the formation of hydroperoxymethyl formate (HPMF, HOOCH2OCHO) which is predicted by the models to be a significant stable intermediate at temperatures below 350 degrees C. Since both formic acid and methyl formate have potentially harmful health effects, these observations may have significant implications for use of DME as a diesel fuel.

  16. Effects of Fuel Temperature on Injection Process and Combustion of Dimethyl Ether Engine.

    Science.gov (United States)

    Guangxin, Gao; Zhulin, Yuan; Apeng, Zhou; Shenghua, Liu; Yanju, Wei

    2013-12-01

    To investigate the effects of fuel temperature on the injection process in the fuel-injection pipe and the combustion characteristics of compression ignition (CI) engine, tests on a four stroke, direct injection dimethyl ether (DME) engine were conducted. Experimental results show that as the fuel temperature increases from 20 to 40 °C, the sound speed is decreased by 12.2%, the peak line pressure at pump and nozzle sides are decreased by 7.2% and 5.6%, respectively. Meanwhile, the injection timing is retarded by 2.2 °CA and the injection duration is extended by 0.8 °CA. Accordingly, the ignition delay and the combustion duration are extended by 0.7 °CA and 4.0 °CA, respectively. The cylinder peak pressure is decreased by 5.4%. As a result, the effective thermal efficiency is decreased, especially for temperature above 40 °C. Before beginning an experiment, the fuel properties of DME, including the density, the bulk modulus, and the sound speed were calculated by "ThermoData." The calculated result of sound speed is consistent with the experimental results.

  17. Extraction of Fucoxanthin from Raw Macroalgae excluding Drying and Cell Wall Disruption by Liquefied Dimethyl Ether

    Directory of Open Access Journals (Sweden)

    Hideki Kanda

    2014-04-01

    Full Text Available Macroalgae are one of potential sources for carotenoids, such as fucoxanthin, which are consumed by humans and animals. This carotenoid has been applied in both the pharmaceutical and food industries. In this study, extraction of fucoxanthin from wet brown seaweed Undaria pinnatifida (water content was 93.2% was carried out with a simple method using liquefied dimethyl ether (DME as an extractant in semi-continuous flow-type system. The extraction temperature and absolute pressure were 25 °C and 0.59 MPa, respectively. The liquefied DME was passed through the extractor that filled by U. pinnatifida at different time intervals. The time of experiment was only 43 min. The amount of fucoxanthin could approach to 390 μg/g dry of wet U. pinnatifida when the amount of DME used was 286 g. Compared with ethanol Soxhlet and supercritical CO2 extraction, which includes drying and cell disruption, the result was quite high. Thus, DME extraction process appears to be a good method for fucoxanthin recovery from U. pinnatifida with improved yields.

  18. Scale study of direct synthesis of dimethyl ether from biomass synthesis gas.

    Science.gov (United States)

    Lv, Yongxing; Wang, Tiejun; Wu, Chuangzhi; Ma, Longlong; Zhou, Yi

    2009-01-01

    We investigated the synthesis of dimethyl ether (DME) from biomass synthesis gas using a kind of hybrid catalyst consisting of methanol and HZSM-5 zeolite in a fixed-bed reactor in a 100 ton/year pilot plant. The biomass synthesis gas was produced by oxygen-rich gasification of corn core in a two-stage fixed bed. The results showed that CO conversions reached 82.00% and 73.55%, the selectivities for DME were 73.95% and 69.73%, and the space-time yields were 124.28 kg m(-3) h(-1) and 203.80 kg m(-3) h(-1) when gas hourly space velocities were 650 h(-1) and 1200 h(-1), respectively. Deoxidation and tar removal from biomass synthesis gas was critical to the stable operation of the DME synthesis system. Using single-pass synthesis, the H(2)/CO ratio improved from 0.98-1.17 to 2.12-2.22. The yield of DME would be increased greatly if the exhaust was reused after removal of the CO(2).

  19. Extraction of PCBs and water from river sediment using liquefied dimethyl ether as an extractant.

    Science.gov (United States)

    Oshita, Kazuyuki; Takaoka, Masaki; Kitade, Sin-ichiro; Takeda, Nobuo; Kanda, Hideki; Makino, Hisao; Matsumoto, Tadao; Morisawa, Shinsuke

    2010-02-01

    We investigated whether polychlorinated biphenyls (PCBs) and water could be simultaneously removed from river sediment by solvent extraction using liquefied dimethyl ether (DME) as the extractant. DME exists in a gaseous state at normal temperature and pressure and can dissolve organic substances and some amount of water; therefore, liquefied DME under moderate pressure (0.6-0.8 MPa) at room temperature can be effectively used to extract PCBs and water from contaminated sediment, and it can be recovered from the extract and reused easily. First, we evaluated the PCB and water extraction characteristics of DME from contaminated sediment. We found that 99% of PCBs and 97% of water were simultaneously extracted from the sediment using liquefied DME at an extraction time of 4320 s and a liquefied DME/sediment ratio of 60 mL g(-1). The extraction rate of PCBs and water was expressed in terms of a pseudo-first-order reaction rate. Second, we estimated the amount of DME that was recovered after extraction. We found that 91-92% of DME could be recovered. In other words, approximately 5-10% of DME was lost during extraction and recovery. It is necessary to optimize this process in order to recover DME efficiently. The extraction efficiency of the recovered DME is similar to that of the pure DME. From the results, we conclude that solvent extraction using liquefied DME is suitable for extracting PCBs and water from contaminated sediment. Copyright (c) 2009 Elsevier Ltd. All rights reserved.

  20. Simulated consumer exposure to dimethyl ether and propane/butane in hairsprays.

    Science.gov (United States)

    Hartop, P J; Cook, T L; Adams, M G

    1991-08-01

    Synopsis The potential human exposures from use of dimethyl ether (DME) and 'liquefied petroleum gas'(LPG) arising from use in hairsprays have been assessed. DME and LPG concentrations were measured in the 'breathing zone' of an experimental manikin and an 'accompanying child' designed to simulate human use of hairsprays in a domestic situation and in the breathing zone of a 'stylist' and 'customer' under salon conditions. Results were expressed as the 10 min time weighted average in the air (TWA10) and as the peak concentration in the breathing zone of the 'user'. Following a 10s use of hairspray containing 50% DME or 26% LPG, TWA10 values for an adult user in a closed room (volume 21 m(3)) were on average 114 ppm and 73 ppm respectively. The child TWA10 values were 89 ppm (DME) and 80 ppm (LPG). Leaving the door open during spraying did not significantly alter these values. The peak concentrations measured in the user breathing zone were 1577 ppm of DME and 671 ppm of LPG. Simulated salon use of a hairspray gave a calculated value of 55 ppm DME and 88 ppm LPG for the stylist over an 8 h working period.

  1. Catalytic combustion of dimethyl ether over α-MnO2 nanostructures with different morphologies

    Science.gov (United States)

    Cheng, Gao; Yu, Lin; He, Binbin; Sun, Ming; Zhang, Bentian; Ye, Wenjin; Lan, Bang

    2017-07-01

    Herein, α-MnO2 catalysts with three well-defined morphologies (nanorod, ultra-long nanowire and microsphere) were rational designed and prepared by the hydrothermal route, and their catalytic activities were evaluated for the dimethyl ether (DME) combustion. These nanostructured α-MnO2 catalysts were characterized in detail by various analytical techniques: XRD, FESEM, TEM, BET, XPS and H2-TPR. As a result, the α-MnO2 nanorod exhibited the higher catalytic activity (T10 = 170 °C and T90 = 238 °C at WHSV = 30,000 mL g-1 h-1) than the other two α-MnO2 samples due to its larger specific surface area, higher average oxidation state of Mn, more abundant surface lattice oxygen (Olatt) species and higher reducibility, and there was no obvious decrease after the α-MnO2 nanorod was run for 50 h. Moreover, the transient response technique revealed that the Olatt species of the α-MnO2 nanorod should be the crucial role in the deep oxidation of DME.

  2. Anode reaction mechanism and crossover in direct dimethyl ether fuel cell

    Science.gov (United States)

    Mizutani, Itsuko; Liu, Yan; Mitsushima, Shigenori; Ota, Ken-ichiro; Kamiya, Nobuyuki

    The anode reaction mechanism and the crossover of a direct dimethyl ether fuel cell (DDMEFC) have been investigated. This was done by considering the anode products of the half-cell and DDMEFC experiments. It was found that the CO 2 current efficiency of the DDMEFC was almost 1 at 30-80 °C and that this value was higher than that of a DMFC. The main by-products of the DDMEFC were methyl formate and methanol whose amounts are negligibly small compared to CO 2. With respect to crossover, the influence of DME on the oxygen reduction reaction (ORR) was examined with a half-cell, and the amount of crossover of DME was measured while operating an actually constructed DDMEFC. From these experiments, it was found that DME does not influence the ORR as much as methanol under similar conditions. Furthermore, the amount of crossover of DME decreased with an increase in temperature and current density and it was one-half that of methanol on open circuit and at 80 °C. The CO 2 current efficiency of the DDMEFC is higher than that of a DMFC, and the influence of crossover in the DDMEFC is less than that in the DMFC. Since the temperature dependence of the reactivity of DME is larger than that of methanol, the higher output is expected for the DDMEFC at the elevated temperature. Therefore, the DDMEFC has a promising potential as a portable power source in the future.

  3. Surface reactions of dimethyl ether on γ-Al2O3

    Science.gov (United States)

    Bondarenko, G. N.; Volnina, E. A.; Kipnis, M. A.; Rodionov, A. S.; Samokhin, P. V.; Lin, G. I.

    2016-02-01

    The surface reactions of dimethyl ether (DME) on industrial alumina (γ-Al2O3) were studied by chromatographic analysis of the products at the outlet of the flow reactor and (independently) by diffuse reflectance IR spectroscopy. The major products of the reactions at 250°C were found to be methanol formed in the reaction of DME with hydroxyl groups (the 3720 and 3674 cm-1 bands in the diffuse reflectance spectrum) and various methoxy groups (the 1121, 1070, 695, and 670 cm-1 bands in the differential spectra). The presence of molecularly adsorbed methanol was confirmed by experiments with methanol fed in a high-temperature IR cell. The interaction of the resulting methanol molecule with the hydroxyl group led to the formation of a water molecule in the gas phase and a methoxy group on the oxide surface. Strong adsorption of molecular DME was revealed, which was favored by an increase in the temperature of the preliminary calcination of oxide from 250 to 450-500°C; treatment of alumina with water vapor after its preliminary contact with DME led to a recovery of the hydroxyl coating and a replacement of molecularly adsorbed DME with hydroxyl. The thermal effect recorded in a flow reactor was positive during the adsorption of DME and negative during the desorption of weakly bonded DME. Schemes of formation of methoxy groups in the interaction of DME and methanol with surface hydroxyls were suggested.

  4. Methanol Conversion into Dimethyl Ether on the Anatase TiO2(001) Surface.

    Science.gov (United States)

    Xiong, Feng; Yu, Yan-Yan; Wu, Zongfang; Sun, Guanghui; Ding, Liangbing; Jin, Yuekang; Gong, Xue-Qing; Huang, Weixin

    2016-01-11

    Exploring reactions of methanol on TiO2 surfaces is of great importance in both C1 chemistry and photocatalysis. Reported herein is a combined experimental and theoretical calculation study of methanol adsorption and reaction on a mineral anatase TiO2(001)-(1×4) surface. The methanol-to-dimethyl ether (DME) reaction was unambiguously identified to occur by the dehydration coupling of methoxy species at the fourfold-coordinated Ti(4+) sites (Ti(4c)), and for the first time confirms the predicted higher reactivity of this facet compared to other reported TiO2 facets. Surface chemistry of methanol on the anatase TiO2(001)-(1×4) surface is seldom affected by co-chemisorbed water. These results not only greatly deepen the fundamental understanding of elementary surface reactions of methanol on TiO2 surfaces but also show that TiO2 with a high density of Ti(4c) sites is a potentially active and selective catalyst for the important methanol-to-DME reaction.

  5. Effects of amine organic groups as lattice in ZSM-5 on the hydrolysis of dimethyl ether.

    Science.gov (United States)

    Meeprasert, Jittima; Jungsuttiwong, Siriporn; Truong, Thanh N; Namuangruk, Supawadee

    2013-06-01

    The effects of doping amine to ZSM-5 on its catalytic activity for hydrolysis of dimethyl ether (DME) have been studied theoretically using Density Functional Theory with the embedded cluster ONIOM(M06/6-31G(d,p):UFF) model. Doping by amine to ZSM-5 yields two new active centers, namely the protonated Z[NH2] and non-protonated Z[NH] amine sites in addition to the normal Brønsted acid Z[OH] site. The reaction has two possible stepwise and concerted channels. The stepwise channel consists of two elementary steps; (i) the demethylation followed by (ii) the hydrolysis while the concerted channel involves in the demethylation and hydrolysis in a single step. We found that the reaction favors to proceed via the concerted channel at all three active centers. The results predict that the Z[OH] shows the best catalytic performance for the studied reaction. The Z[NH2] is not catalytically active due to the activation barriers are extremely high for both stepwise and concerted pathways. The demethylation step is energetically favorable over the Z[NH] site, however, the product methylamonium surface intermediate is too stable to be further converted to methanol.

  6. A Hierarchically Micro-Meso-Macroporous Zeolite CaA for Methanol Conversion to Dimethyl Ether

    Directory of Open Access Journals (Sweden)

    Yan Wang

    2016-11-01

    Full Text Available A hierarchical zeolite CaA with microporous, mesoporous and macroporous structure was hydrothermally synthesized by a ”Bond-Blocking” method using organo-functionalized mesoporous silica (MS as a silica source. The characterization by XRD, SEM/TEM and N2 adsorption/desorption techniques showed that the prepared material had well-crystalline zeolite Linde Type A (LTA topological structure, microspherical particle morphologies, and hierarchically intracrystalline micro-meso-macropores structure. With the Bond-Blocking principle, the external surface area and macro-mesoporosity of the hierarchical zeolite CaA can be adjusted by varying the organo-functionalized degree of the mesoporous silica surface. Similarly, the distribution of the micro-meso-macroporous structure in the zeolite CaA can be controlled purposely. Compared with the conventional microporous zeolite CaA, the hierarchical zeolite CaA as a catalyst in the conversion of methanol to dimethyl ether (DME, exhibited complete DME selectivity and stable catalytic activity with high methanol conversion. The catalytic performances of the hierarchical zeolite CaA results clearly from the micro-meso-macroporous structure, improving diffusion properties, favoring the access to the active surface and avoiding secondary reactions (no hydrocarbon products were detected after 3 h of reaction.

  7. The performance of chemically and physically modified local kaolinite in methanol dehydration to dimethyl ether

    Directory of Open Access Journals (Sweden)

    Sanaa M. Solyman

    2014-09-01

    Full Text Available The catalytic activity of modified natural kaolinite as a solid acid catalyst for dimethyl ether (DME preparation was investigated by following up the conversion% of methanol and the yield% of DME. Natural kaolinite (KN was treated chemically with H2O2 (KT followed by thermal treatment at 500 °C (KC and then mechano-chemically by ball milling with and without CaSO4 (KB-Ca and KB, respectively. These samples were characterized by XRD, FTIR, SEM, HRTEM, TGA and NH3-TPD techniques. The different techniques showed that the chemical treatment of kaolinite with H2O2 resulted in partial exfoliation/delamination of kaolinite, decreased the amount of acidic sites which is accompanied by increasing their strength. Calcination only decreased the acidic strength and slightly enlarged the particle size mostly due to heat effect. Ball milling resulted in multitude randomly-oriented crystals and increased the amount of acidic sites with the same strength of KT sample. CaSO4 mostly produced ordered monocrystalline kaolinite and created new acidic sites with slightly lower strength relative to KB. The catalytic activity and selectivity depend on the reaction temperature, the space velocity and the strength of acid sites. The most active sample is KB-Ca, which gives 84% DME due to its high amount and strength of acidic sites. The different modification methods resulted in 100% selectivity for DME.

  8. Numerical and Experimental Study on the Combustion and Emission Characteristics of a Dimethyl Ether (DME) Fueled Compression Ignition Engine Études numériques et expérimentales sur les caractéristiques de combustion et d’émissions d’un éther diméthylique (EDM)- moteur à auto-allumage rempli de combustible

    National Research Council Canada - National Science Library

    Kim Hyung Jun; Park Sung Wook; Lee Chang Sik

    2012-01-01

    ...) with wide ranges of injection timings in compression ignition engines. In order to simulate DME combustion processes, a KIVA-3V code coupled with a chemistry solver was used to solve the detailed chemical kinetics model of DME oxidation...

  9. DFT study on the adsorption of diethyl, ethyl methyl, and dimethyl ethers on the surface of gallium doped graphene

    Science.gov (United States)

    Shokuhi Rad, Ali; Sani, Emad; Binaeian, Ehsan; Peyravi, Majid; Jahanshahi, Mohsen

    2017-04-01

    In this study, we used density functional theory (DFT) to search on the adsorption properties of three important compounds of ether family; diethyl ether (DEE), ethyl methyl ether (EME), and dimethyl ether (DME) on the surface of Gallium doped graphene (GaG). We used three functionals (B3LYP, wb97xd, and MPW1PW91) for optimization and calculation of adsorption energy. After fully optimization, we scrutinized on the charge allocations on the adsorbed ethers as well as GaG (at the area of interaction) based on natural bond orbitals (NBO). Besides, we have calculated the amount of charge transfer upon adsorption of each analyte. We revel that GaG is an ideal adsorbent for chemisorption of all above-mentioned ethers. There is a little difference between the values of adsorption; -123.5, -120, and -118.3 kJ/mol (based on wb97xd) for DEE, EME, and DME, respectively. We found significant changes in the electronic structure of both adsorbent and adsorbate upon adsorption. Moreover, results of charge analyses confirm GaG is a p-type semiconductor.

  10. Experimental and Modeling Investigation of the Low-Temperature Oxidation of Dimethyl Ether.

    Science.gov (United States)

    Rodriguez, Anne; Frottier, Ophélie; Herbinet, Olivier; Fournet, René; Bounaceur, Roda; Fittschen, Christa; Battin-Leclerc, Frédérique

    2015-07-16

    The oxidation of dimethyl ether (DME) was studied using a jet-stirred reactor over a wide range of conditions: temperatures from 500 to 1100 K; equivalence ratios of 0.25, 1, and 2; residence time of 2 s; pressure of 106.7 kPa (close to the atmospheric pressure); and an inlet fuel mole fraction of 0.02 (with high dilution in helium). Reaction products were quantified using two analysis methods: gas chromatography and continuous wave cavity ring-down spectroscopy (cw-CRDS). cw-CRDS enabled the quantification of formaldehyde, which is one of the major products from DME oxidation, as well as that of hydrogen peroxide, which is an important branching agent in low-temperature oxidation chemistry. Experimental data were compared with data computed using models from the literature with important deviations being observed for the reactivity at low-temperature. A new detailed kinetic model for the oxidation of DME was developed in this study. Kinetic parameters used in this model were taken from literature or calculated in the present work using quantum calculations. This new model enables a better prediction of the reactivity in the low-temperature region. Under the present JSR conditions, error bars on predictions were given. Simulations were also successfully compared with experimental flow reactor, jet-stirred reactor, shock tube, rapid compression machine, and flame data from literature. The kinetic analysis of the model enabled the highlighting of some specificities of the oxidation chemistry of DME: (1) the early reactivity which is observed at very low-temperature (e.g., compared to propane) is explained by the absence of inhibiting reaction of the radical directly obtained from the fuel (by H atom abstraction) with oxygen yielding an olefin + HO2·; (2) the low-temperature reactivity is driven by the relative importance of the second addition to O2 (promoting the reactivity through branching chain) and the competitive decomposition reactions with an inhibiting

  11. Variational Effect and Anharmonic Torsion on Kinetic Modeling for Initiation Reaction of Dimethyl Ether Combustion.

    Science.gov (United States)

    Guan, Yulei; Gao, Jing; Song, Yiming; Li, Yang; Ma, Haixia; Song, Jirong

    2017-02-09

    The reaction of dimethyl ether (DME) with molecular oxygen has been considered to be the dominant initiation pathway for DME combustion compared to the C-O bond fission. This work presents a detailed mechanism and kinetics investigation for the O2 + DME reaction with theoretical approaches. Using the CCSD(T)/6-311+G(2df,2pd) potential energy surface with the M06-2X/MG3S gradient, Hessian, and geometries, rate constants are evaluated by multistructural canonical variational transition-state theory (MS-CVT) including contributions from hindered rotation and multidimensional tunneling over the temperature range 200-2800 K. The CCSD(T) and QCISD(T) with 6-311+G(2df,2pd) calculations predict a barrier of 190-194 kJ mol(-1) for the O2 + DME reaction based on the optimized structures at various levels. It is proposed that there exists a weakly interacting adducts on the product side with subsequent dissociation to the separate HO2 and CH3OCH2 radicals. Torsions in transition state are found to be significantly coupled to generate four conformations whose contributions do influence the rate constant predictions. Variational effects are observed to be significant at high temperatures, while tunneling effect quickly becomes insignificant with temperature. Finally, four-parameter Arrhenius expression 9.14 × 10(13)(T/300)(-3.15) exp[-184.52(T + 110.23)/(T(2) + 110.23(2))] cm(3) mol(-1) s(-1) describes the temperature dependence of MS-CVT rate constants with small-curvature tunneling correction.

  12. Analysis of first stage ignition delay times of dimethyl ether in a laminar flow reactor

    Science.gov (United States)

    Wada, Tomoya; Sudholt, Alena; Pitsch, Heinz; Peters, Norbert

    2013-10-01

    The combustion chemistry of the first stage ignition and chemistry/flow interactions are studied for dimethyl ether (DME) with a mathematical analysis of two systems: a plug flow reactor study is used to reduce the reaction chemistry systematically. A skeletal reaction mechanism for the low temperature chemistry of DME until the onset of ignition is derived on the basis of the detailed DME mechanism of the Lawrence Livermore National Laboratory - see Curran, Fischer and Dryer, Int. J. Chem. Kinetics, Vol. 32 (2000). It is shown that reasonably good results for ignition delay times can be reached using a simple system of three ordinary differential equations and that the resulting analytical solution depends only on two reaction rates and the initial fuel concentration. The stepwise reduction of the system based on assumptions yields an understanding on why these reactions are so important. Furthermore, the validation of the assumptions yields insight into the influence of the fuel and the oxygen concentration on the temperature during the induction phase. To investigate the influence of chemistry/flow interactions, a 2D model with a laminar Hagen-Poiseuille flow and 2D-polynomial profiles for the radial species concentration is considered. For the 2D model, it is found that only the diffusion coefficients and the reactor radius need to be taken into consideration additionally to describe the system sufficiently. Also, the coupling of flow and chemistry is clarified in the mathematical analysis. The insight obtained from the comparison of the 2D model and the plug flow model is used to establish an average velocity for the conversion of ignition locations to ignition delay times in a laminar flow reactor. Finally, the 2D analytical solution is compared against new experimental data, obtained in such a laminar flow reactor for an undiluted DME/air mixture with an equivalence ratio of φ = 0.835 and a temperature range of 555 to 585 K at atmospheric pressure.

  13. Extraction of chili, black pepper, and ginger with near-critical CO2, propane, and dimethyl ether: analysis of the extracts by quantitative nuclear magnetic resonance.

    Science.gov (United States)

    Catchpole, Owen J; Grey, John B; Perry, Nigel B; Burgess, Elaine J; Redmond, Wayne A; Porter, Noel G

    2003-08-13

    Ginger, black pepper, and chili powder were extracted using near-critical carbon dioxide, propane, and dimethyl ether on a laboratory scale to determine the overall yield and extraction efficiency for selected pungent components. The temperature dependency of extraction yield and efficiency was also determined for black pepper and chili using propane and dimethyl ether. The pungency of the extracts was determined by using an NMR technique developed for this work. The volatiles contents of ginger and black pepper extracts were also determined. Extraction of all spice types was carried out with acetone to compare overall yields. Subcritical dimethyl ether was as effective at extracting the pungent principles from the spices as supercritical carbon dioxide, although a substantial amount of water was also extracted. Subcritical propane was the least effective solvent. All solvents quantitatively extracted the gingerols from ginger. The yields of capsaicins obtained by supercritical CO(2) and dimethyl ether were similar and approximately double that extracted by propane. The yield of piperines obtained by propane extraction of black pepper was low at approximately 10% of that achieved with dimethyl ether and CO(2), but improved with increasing extraction temperature.

  14. The potential of di-methyl ether (DME) as an alternative fuel for compression-ignition engines: A review

    OpenAIRE

    Arcoumanis, C.; Bae, C.; Crookes, R.; Kinoshita, E

    2008-01-01

    This paper reviews the properties and application of di-methyl ether (DME) as a candidate fuel for compression-ignition engines. DME is produced by the conversion of various feedstock such as natural gas, coal, oil residues and bio-mass. To determine the technical feasibility of DME, the review compares its key properties with those of diesel fuel that are relevant to this application. DME’s diesel engine-compatible properties are its high cetane number and low auto-ignition temperature. In a...

  15. Comparison of Coal-Based Dimethyl Ether and Diesel as Vehicle Fuels from Well to Wheel in China

    Institute of Scientific and Technical Information of China (English)

    ZHANG Liang; HUANG Zhen

    2009-01-01

    With life cycle assessment (LCA) methodology, a life cycle model of coal-based vehicle fuels (CBVFs) including coal-based dimethyl ether (CBDME) and coal-based diesel (CBD) is established. Their primary energy consumption (PEC) and global warming potential (GWP) from well to wheel including feedstock extraction, fuel production, fuel consumption in vehicle and energy transportation are calculated and compared. Results show that the life cycle PEC and GWP of CBD pathway are 1.17 and 1.34 times as CBDME pathway. Based on the above results, CBDME will become a choice with great potential to replace conventional petroleum-based diesel (CPBD) in China.

  16. Decomposition of Ethanol and Dimethyl Ether during Chemical Vapor Deposition Synthesis of Single-Walled Carbon Nanotubes

    Science.gov (United States)

    Hou, Bo; Xiang, Rong; Inoue, Taiki; Einarsson, Erik; Chiashi, Shohei; Shiomi, Junichiro; Miyoshi, Akira; Maruyama, Shigeo

    2011-06-01

    In this study, we investigated carbon feedstock decomposition conditions on the synthesis of single-walled carbon nanotubes (SWNTs) by chemical vapor deposition. We simulated gas-phase thermal decomposition of ethanol and dimethyl ether (DME) at typical SWNT growth conditions using the chemical kinetic model, and confirmed the reaction trends and primary products using Fourier transform infrared (FT-IR) spectroscopy. Molar fractions were correlated against residence time in the reactor by adjusting the volumetric gas flow rate, and concentration profiles of reaction species were compared to the predicted decomposition mechanism. Signature peak intensities indicated concentrations of both ethanol and DME.

  17. Thermodynamic analysis of small-scale dimethyl ether (DME) and methanol plants based on the efficient two-stage gasifier

    DEFF Research Database (Denmark)

    Clausen, Lasse Røngaard; Elmegaard, Brian; Ahrenfeldt, Jesper

    2011-01-01

    Models of dimethyl ether (DME) and methanol synthesis plants have been designed by combining the features of the simulation tools DNA and Aspen Plus. The plants produce DME or methanol by catalytic conversion of a syngas generated by gasification of woody biomass. Electricity is co......-produced in the plants by a gas engine utilizing the unconverted syngas. A two-stage gasifier with a cold gas efficiency of 93% is used, but because of the design of this type of gasifier, the plants have to be of small-scale (5 MWth biomass input). The plant models show energy efficiencies from biomass to DME/methanol...

  18. Effect of Dimethyl Ether Mixing on Soot Size Distribution in Premixed Ethylene Flame

    KAUST Repository

    Li, Zepeng

    2016-04-21

    As a byproduct of incomplete combustion, soot attracts increasing attentions as extensive researches exploring serious health and environmental effects from soot particles. Soot emission reduction requires a comprehensive understanding of the mechanism for polycyclic aromatic hydrocarbons and of soot formation and aging processes. Therefore, advanced experimental techniques and numerical simulations have been conducted to investigate this procedure. In order to investigate the effects of dimethyl ether (DME) mixing on soot particle size distribution functions (PSDFs), DME was mixed in premixed ethylene/oxygen/argon at flames at the equivalence ratio of 2.0 with a range of mixing ratio from 0% to 30% of the total carbon fed. Two series of atmospheric pressure flames were tested in which cold gas velocity was varied to obtain different flame temperatures. The evolution of PSDFs along the centerline of the flame was determined by burner stabilized stagnation probe and scanning mobility particle sizer (SMPS) techniques, yielding the PSDFs for various separation distances above the burner surface. Meanwhile, the flame temperature profiles were carefully measured by a thermocouple and the comparison to that of simulated laminar premixed burner-stabilized stagnation flame was satisfactory. Additionally, to understand the chemical role of DME mixing in soot properties, characterization measurements were conducted on soot samples using thermo-gravimetric analysis (TGA) and elemental analysis (EA). Results of the evolution of PSDFs and soot volume fraction showed that adding DME into ethylene flame could reduce soot yield significantly. The addition of DME led to the decrease of both the soot nucleation rate and the particle mass growth rate. To explain the possible mechanism for the observation, numerical simulations were performed. Although DME addition resulted in the slight increase of methyl radicals from pyrolysis, the decrease in acetylene and propargyl radicals

  19. Structural requirements and reaction pathways in dimethyl ether combustion catalyzed by supported Pt clusters.

    Science.gov (United States)

    Ishikawa, Akio; Neurock, Matthew; Iglesia, Enrique

    2007-10-31

    The identity and reversibility of the elementary steps required for catalytic combustion of dimethyl ether (DME) on Pt clusters were determined by combining isotopic and kinetic analyses with density functional theory estimates of reaction energies and activation barriers to probe the lowest energy paths. Reaction rates are limited by C-H bond activation in DME molecules adsorbed on surfaces of Pt clusters containing chemisorbed oxygen atoms at near-saturation coverages. Reaction energies and activation barriers for C-H bond activation in DME to form methoxymethyl and hydroxyl surface intermediates show that this step is more favorable than the activation of C-O bonds to form two methoxides, consistent with measured rates and kinetic isotope effects. This kinetic preference is driven by the greater stability of the CH3OCH2* and OH* intermediates relative to chemisorbed methoxides. Experimental activation barriers on Pt clusters agree with density functional theory (DFT)-derived barriers on oxygen-covered Pt(111). Measured DME turnover rates increased with increasing DME pressure, but decreased as the O2 pressure increased, because vacancies (*) on Pt surfaces nearly saturated with chemisorbed oxygen are required for DME chemisorption. DFT calculations show that although these surface vacancies are required, higher oxygen coverages lead to lower C-H activation barriers, because the basicity of oxygen adatoms increases with coverage and they become more effective in hydrogen abstraction from DME. Water inhibits reaction rates via quasi-equilibrated adsorption on vacancy sites, consistent with DFT results indicating that water binds more strongly than DME on vacancies. These conclusions are consistent with the measured kinetic response of combustion rates to DME, O2, and H2O, with H/D kinetic isotope effects, and with the absence of isotopic scrambling in reactants containing isotopic mixtures of 18O2-16O2 or 12CH3O12CH3-13CH3O13CH3. Turnover rates increased with Pt

  20. Study on hexaaluminate MnLaAl11O19-δcatalyst for catalytic combustive reaction of dimethyl ether as a new fuel

    Institute of Scientific and Technical Information of China (English)

    YU Qian; YU Lin; HUANG Yingmin; SUN Ming; CHEN Xiaokang; WANG Yuanna; ZHANG Qini

    2006-01-01

    Study on catalytic combustive reaction of dimethyl ether as a new fuel was presented. Hexaaluminate catalysts were used to reduce ignition temperature so that dimethyl ether completely combusted at low temperature. Hexaaluminate catalysts MnLaAl11O19-δ were prepared by reverse microemulsion method. Crystalline phase and structure of the catalyst were analysed by means of TG-DTA, XRD and BET. The results show that the hexaalunminate is of magnetoplumbite structure when La is taken as mirror plane cation. Hexaalunminate phase is formed slowly via 1050 ℃ calcined for 4 h and it can keep hexaaluminate phase and high surface area of 48 m2·g-1 even calcined at 1200 ℃ for 2h. Catalytic activity of MnLaAl11O19-δ was tested in combustion reaction of dimethyl ether. It shows that hexaaluminate is of high activity with T 10% at 170 ℃ and almost 100% conversion at 370 ℃.

  1. Multi-walled carbon nanotubes as catalyst promoter for dimethyl ether synthesis from CO{sub 2} hydrogenation

    Energy Technology Data Exchange (ETDEWEB)

    Zha, Fei, E-mail: zhafei@nwnu.edu.cn [College of Chemistry and Chemical Engineering, Northwest Normal University, Lanzhou 730070 (China); Tian, Haifeng; Yan, Jun [College of Chemistry and Chemical Engineering, Northwest Normal University, Lanzhou 730070 (China); Chang, Yue [College of Chemistry and Chemical Engineering, Northwest Normal University, Lanzhou 730070 (China); Key Laboratory of Polymer Material of Gansu Province, Lanzhou 730070 (China)

    2013-11-15

    The mixed acid of H{sub 2}SO{sub 4}/HNO{sub 3}-pretreated multi-walled carbon nanotubes was employed as supports and ultrasound-assisted co-precipitation method was designed to prepare multi-walled carbon nanotubes supported CuO–ZnO–Al{sub 2}O{sub 3}/HZSM-5 catalyst. The catalyst was characterized by means of X-ray diffraction spectrum (XRD), scanning electron microscope (SEM), transmission electron microscopy (TEM), thermal analysis (TG) and Brunauer–Emmett–Teller (BET). The catalyst activity for the preparation of dimethyl ether from hydrogenation of CO{sub 2} was investigated in a fixed-bed reactor, which showed that multi-walled carbon nanotubes could promote the catalyst activity of CuO–ZnO–Al{sub 2}O{sub 3}/HZSM-5. Under the reaction conditions of temperature at 262 °C, pressure at 3.0 MPa, H{sub 2}/CO{sub 2} = 3 (volume ratio) and space velocity (SV) = 1800 mL g{sub cat}{sup −1} h{sup −1}, the conversion per pass of carbon dioxide was 46.2%, with the dimethyl ether yield and selectivity of 20.9% and 45.2%.

  2. An experimental study on the spray characteristics of diesel-dimethyl ether (DME) blended fuels by phase doppler anemometry

    Institute of Scientific and Technical Information of China (English)

    2009-01-01

    This paper presents an experimental study on the spray characteristics of diesel-dimethyl ether (DME) blended fuels by phase doppler anemometry (PDA). Blended fuels with DME mass fractions of 15%, 30% and pure diesel fuel were used to evaluate the effect of the DME concentration on the spray pattern, droplet size and velocity. The data for spray velocity vector and droplet size field were obtained. The experimental results reveal that the micro-explosive function exists in the jet of diesel-dimethyl ether (DME) blended fuels and the radial velocity of the blended fuels spray is larger than that of conventional diesel fuel spray near the nozzle exit. At the downstream part of the spray, the radial velocity and its attenuation rate of blended fuels are much more uniform and smaller than those of pure diesel spray. At the centerline of the spray, the attenuation rates of all spray axial velocities are similar. With the in- crease of DME concentration in the fuel, the spray angle and the exit velocity increase and the droplet size deceases.

  3. An experimental study on the spray characteristics of diesel-dimethyl ether (DME) blended fuels by phase doppler anemometry

    Institute of Scientific and Technical Information of China (English)

    XIAO Jin; HUANG Zhen; QIAO XinQi

    2009-01-01

    This paper presents an experimental study on the spray characteristics of diesel-dimethyl ether (DME) blended fuels by phase doppler anemometry (PDA). Blended fuels with DME mass fractions of 15%,30% and pure diesel fuel were used to evaluate the effect of the DME concentration on the spray pattern,droplet size and velocity. The data for spray velocity vector and droplet size field were obtained. The experimental results reveal that the micro-explosive function exists in the jet of diesel-dimethyl ether (DME) blended fuels and the radial velocity of the blended fuels spray is larger than that of conventional diesel fuel spray near the nozzle exit. At the downstream part of the spray, the radial velocity and its attenuation rate of blended fuels are much more uniform and smaller than those of pure diesel spray. At the centerline of the spray, the attenuation rates of all spray axial velocities are similar. With the increase of DME concentration in the fuel, the spray angle and the exit velocity increase and the droplet size deceases.

  4. The effect of physical and chemical treatment on nano-zeolite characterization and their performance in dimethyl ether preparation

    Directory of Open Access Journals (Sweden)

    Sanaa M. Solyman

    2015-09-01

    Full Text Available Catalytic dehydration of methanol to dimethyl ether (DME was investigated using physically and chemically modified H-Mordenite and H-Beta zeolites as catalysts. Physical modification was carried out using ultrasonic wave’s energy, while chemical modification was performed through impregnation in aluminum nitrate followed by calcination. The produced solid catalysts were evaluated as selective catalysts for the dehydration of methanol to dimethyl ether at 100–250 °C performed at three different contact times. Chemical and structural characterizations of the solid catalysts were identified using XRD, FT-IR, TEM, SEM and NH3-TPD. Ultrasonication physical mixing of solids proved as useful tool of preparation, producing fine reordered crystals of nanocomposite zeolites with novel morphology. The newly ordered crystals were distinguished by their frame work structure, acidic properties, crystal and particle sizes, unit cell volume, pore opening, and favorable catalytic activity of 100% selectivity to DME at 200 °C for all contact times studied. The effects of Al2O3 on the dispersion and interaction within the nano-zeolite crystals and hence on the catalytic dehydration of methanol were verified as the major influence toward utmost selectivity.

  5. Quantum-mechanical study of energies, structures, and vibrational spectra of the H(D)Cl complexed with dimethyl ether

    Energy Technology Data Exchange (ETDEWEB)

    Boda, Łukasz, E-mail: lboda@chemia.uj.edu.pl; Boczar, Marek; Gług, Maciej; Wójcik, Marek J. [Faculty of Chemistry, Jagiellonian University, Ingardena 3, 30-060 Kraków (Poland)

    2015-11-28

    Interaction energies, molecular structure and vibrational frequencies of the binary complex formed between H(D)Cl and dimethyl ether have been obtained using quantum-chemical methods. Equilibrium and vibrationally averaged structures, harmonic and anharmonic wavenumbers of the complex and its deuterated isotopomer were calculated using harmonic and anharmonic second-order perturbation theory procedures with Density Functional Theory B3LYP and B2PLYP-D and ab initio Møller-Plesset second-order methods, and a 6-311++G(3d,3p) basis set. A phenomenological model describing anharmonic-type vibrational couplings within hydrogen bonds was developed to explain the unique broadening and fine structure, as well as the isotope effect of the Cl–H and Cl–D stretching IR absorption bands in the gaseous complexes with dimethyl ether, as an effect of hydrogen bond formation. Simulations of the rovibrational structure of the Cl–H and Cl–D stretching bands were performed and the results were compared with experimental spectra.

  6. Cannabidiol-2',6'-dimethyl ether stimulates body weight gain in apolipoprotein E-deficient BALB/c. KOR/Stm Slc-Apoe(shl) mice.

    Science.gov (United States)

    Takeda, Shuso; Hirota, Rena; Teradaira, Sari; Takeda-Imoto, Masumi; Watanabe, Kazuhito; Toda, Akihisa; Aramaki, Hironori

    2015-12-01

    The biological activities of cannabidiol (CBD), a major non-psychotropic constituent of the fiber-type cannabis plant, have been examined in detail (e.g., CBD modulation of body weight in mice and rats). However, few studies have investigated the biological activities of cannabidiol-2',6'-dimethyl ether (CBDD), a dimethyl ether derivative of the parent CBD. We herein focused on the effects of CBDD on body weight changes in mice, and demonstrated that it stimulated body weight gain in apolipoprotein E (ApoE)-deficient BALB/c. KOR/Stm Slc-Apoe(shl) mice, especially between 10 and 20 weeks of age.

  7. 二甲醚在燃料电池中的应用现状%Application status quo of dimethyl ether(DME)in fuel cell

    Institute of Scientific and Technical Information of China (English)

    杨滔; 尹鸽平; 蔡克迪

    2009-01-01

    分别从直接二甲醚(DME)燃料电池(DDFC)、以DME为燃料的固体氧化物燃料电池(SOFC)和DME重整制氢用于燃料电池等研究方向,介绍了DME在燃料电池中的应用现状.%Application status quo of dimethyl ether (DME) in fuel cell was introduced from the research directions of direct dimethyl ether fuel cell(DDFC) ,solid oxide fuel cell(SOFC)fueled with DME and hydrogen generation from reforming DME for fuel cell.

  8. Selective homogeneous and heterogeneous catalytic conversion of methanol/dimethyl ether to triptane.

    Science.gov (United States)

    Hazari, Nilay; Iglesia, Enrique; Labinger, Jay A; Simonetti, Dante A

    2012-04-17

    The demand for specific fuels and chemical feed-stocks fluctuates, and as a result, logistical mismatches can occur in the supply of their precursor raw materials such as coal, biomass, crude oil, and methane. To overcome these challenges, industry requires a versatile and robust suite of conversion technologies, many of which are mediated by synthesis gas (CO + H(2)) or methanol/dimethyl ether (DME) intermediates. One such transformation, the conversion of methanol/DME to triptane (2,2,3-trimethylbutane) has spurred particular research interest. Practically, triptane is a high-octane, high-value fuel component, but this transformation also raises fundamental questions: how can such a complex molecule be generated from such a simple precursor with high selectivity? In this Account, we present studies of this reaction carried out in two modes: homogeneously with soluble metal halide catalysts and heterogeneously over solid microporous acid catalysts. Despite their very different compositions, reaction conditions, provenance, and historical scientific context, both processes lead to remarkably similar products and mechanistic interpretations. In both cases, hydrocarbon chains grow by successive methylation in a carbocation-based mechanism. The relative rates of competitive processes-chain growth by methylation, chain termination by hydrogen transfer, isomerization, and cracking-systematically depend upon the structure of the various hydrocarbons produced, strongly favoring the formation of the maximally branched C(7) alkane, triptane. The two catalysts also show parallels in their dependence on acid strength. Stronger acids exhibit higher methanol/DME conversion but also tend to favor chain termination, isomerization, and cracking relative to chain growth, decreasing the preference for triptane. Hence, in both modes, there will be an optimal range: if the acid strength is too low, activity will be poor, but if it is too high, selectivity will be poor. A related

  9. Single-Step Syngas-to-Distillates (S2D) Synthesis via Methanol and Dimethyl Ether Intermediates: Final Report

    Energy Technology Data Exchange (ETDEWEB)

    Dagle, Robert A.; Lebarbier, Vanessa MC; Lizarazo Adarme, Jair A.; King, David L.; Zhu, Yunhua; Gray, Michel J.; Jones, Susanne B.; Biddy, Mary J.; Hallen, Richard T.; Wang, Yong; White, James F.; Holladay, Johnathan E.; Palo, Daniel R.

    2013-11-26

    The objective of the work was to enhance price-competitive, synthesis gas (syngas)-based production of transportation fuels that are directly compatible with the existing vehicle fleet (i.e., vehicles fueled by gasoline, diesel, jet fuel, etc.). To accomplish this, modifications to the traditional methanol-to-gasoline (MTG) process were investigated. In this study, we investigated direct conversion of syngas to distillates using methanol and dimethyl ether intermediates. For this application, a Pd/ZnO/Al2O3 (PdZnAl) catalyst previously developed for methanol steam reforming was evaluated. The PdZnAl catalyst was shown to be far superior to a conventional copper-based methanol catalyst when operated at relatively high temperatures (i.e., >300°C), which is necessary for MTG-type applications. Catalytic performance was evaluated through parametric studies. Process conditions such as temperature, pressure, gas-hour-space velocity, and syngas feed ratio (i.e., hydrogen:carbon monoxide) were investigated. PdZnAl catalyst formulation also was optimized to maximize conversion and selectivity to methanol and dimethyl ether while suppressing methane formation. Thus, a PdZn/Al2O3 catalyst optimized for methanol and dimethyl ether formation was developed through combined catalytic material and process parameter exploration. However, even after compositional optimization, a significant amount of undesirable carbon dioxide was produced (formed via the water-gas-shift reaction), and some degree of methane formation could not be completely avoided. Pd/ZnO/Al2O3 used in combination with ZSM-5 was investigated for direct syngas-to-distillates conversion. High conversion was achieved as thermodynamic constraints are alleviated when methanol and dimethyl are intermediates for hydrocarbon formation. When methanol and/or dimethyl ether are products formed separately, equilibrium restrictions occur. Thermodynamic relaxation also enables the use of lower operating pressures than what

  10. Interface Properties between Lithium Metal and a Composite Polymer Electrolyte of PEO18Li(CF3SO2)2N-Tetraethylene Glycol Dimethyl Ether

    National Research Council Canada - National Science Library

    Wang, Hui; Matsui, Masaki; Takeda, Yasuo; Yamamoto, Osamu; Im, Dongmin; Lee, Dongjoon; Imanishi, Nobuyuki

    2013-01-01

    ...(trifluoromethanesulfonyl)imide (LiTFSI) and tetraethylene glycol dimethyl ether (TEGDME) was examined as a protective layer between lithium metal and a water-stable lithium ion-conducting glass ceramic of Li1+x+y(Ti,Ge)2-xAlxP3-ySiyO12 (LTAP...

  11. Assessing the techno-environmental performance of CO2 utilization via dry reforming of methane for the production of dimethyl ether

    NARCIS (Netherlands)

    Schakel, Wouter; Oreggioni, Gabriel; Singh, Bhawna; Strømman, Anders; Ramírez, Andrea

    2016-01-01

    Abstract CO2 utilization is gaining attention as a greenhouse gas abatement strategy complementary to CO2 storage. This study explores the techno-environmental performance of CO2 utilization trough dry reforming of methane into syngas for the production of dimethyl ether (DME). The CO2 source is a h

  12. Assessing the techno-environmental performance of CO2 utilization via dry reforming of methane for the production of dimethyl ether

    NARCIS (Netherlands)

    Schakel, Wouter|info:eu-repo/dai/nl/369280784; Oreggioni, Gabriel; Singh, Bhawna; Strømman, Anders; Ramírez, Andrea|info:eu-repo/dai/nl/284852414

    2016-01-01

    Abstract CO2 utilization is gaining attention as a greenhouse gas abatement strategy complementary to CO2 storage. This study explores the techno-environmental performance of CO2 utilization trough dry reforming of methane into syngas for the production of dimethyl ether (DME). The CO2 source is a h

  13. Modelling-based Optimisation of the Direct Synthesis of Dimethyl Ether from Syngas in a Commercial Slurry Reactor

    Institute of Scientific and Technical Information of China (English)

    Sadegh Papari; Mohammad Kazemeini; Moslem Fattahi

    2013-01-01

    In the present study,we developed a multi-component one-dimensional mathematical model for simulation and optimisation of a commercial catalytic slurry reactor for the direct synthesis of dimethyl ether (DME) from syngas and CO2,operating in a chum-turbulent regime.DME productivity and CO conversion were optimised by tuning operating conditions,such as superficial gas velocity,catalyst concentration,catalyst mass over molar gas flow rate (W/F),syngas composition,pressure and temperature.Reactor modelling was accomplished utilising mass balance,global kinetic models and heterogeneous hydrodynamics.In the heterogeneous flow regime,gas was distributed into two bubble phases:small and large.Simulation results were validated using data obtained from a pilot plant.The developed model is also applicable for the design of large-scale slurry reactors.

  14. Preparation of nanocrystalline γ-A1203 catalyst using different procedures for methanol dehydration to dimethyl ether

    Institute of Scientific and Technical Information of China (English)

    Ahmad Reza Keshavarz; Mehran Rezaei; Fereydoon Yaripour

    2011-01-01

    A series of nanocrystalline γ-alumina are synthesized by different procedures, namely, thermal decomposition method (sample A), precipitation method (sample B) and sol-gel method using sucrose and hexadecyltrimethyl ammonium bromide (CTAB) as templates (samples C and D, respectively). Textural and acidic properties of T-alumina samples are characterized by XRD, N2 adsorption-desorption and NH3-TPD techniques. Vapor-phase dehydration of methanol into dimethyl ether is carried out over these samples. Among them, sample C shows the highest catalytic activity. NH3-TPD analysis reveals that the sample with smaller crystallite size possesses higher concentration of medium acidic sites and consequently higher catalytic activity. Thermal decomposition method leads to decrease in both surface area and moderate acidity, therefore it is the cause of lower catalytic activity.

  15. Direct synthesis of ethanol from dimethyl ether and syngas over combined H-Mordenite and Cu/ZnO catalysts.

    Science.gov (United States)

    Li, Xingang; San, Xiaoguang; Zhang, Yi; Ichii, Takashi; Meng, Ming; Tan, Yisheng; Tsubaki, Noritatsu

    2010-10-25

    Ethanol was directly synthesized from dimethyl ether (DME) and syngas with the combined H-Mordenite and Cu/ZnO catalysts that were separately loaded in a dual-catalyst bed reactor. Methyl acetate (MA) was formed by DME carbonylation over the H-Mordenite catalyst. Thereafter, ethanol and methanol were produced by MA hydrogenation over the Cu/ZnO catalyst. With the reactant gas containing 1.0% DME, the optimized temperature for the reaction was at 493 K to reach 100% conversion. In the products, the yield of methanol and ethanol could reach 46.3% and 42.2%, respectively, with a small amount of MA, ethyl acetate, and CO(2). This process is environmentally friendly as the main byproduct methanol can be recycled to DME by a dehydration reaction. In contrast, for the physically mixed catalysts, the low conversion of DME and high selectivity of methanol were observed.

  16. Super-energy-saving dewatering method for high-specific-surface-area fuels by using dimethyl ether

    Energy Technology Data Exchange (ETDEWEB)

    Kanda, H. [Central Research Institute for Electric Power Industry, Kanagawa (Japan)

    2008-07-01

    There is a growing need for the economical dewatering of high-specific-surface-area fuels containing large amounts of water, such as coal and sewage sludge. The principle underlying conventional dewatering methods is evaporation of the water content by heating the fuels to a high temperature, but this approach consumes a considerable amount of energy. The Central Research Institute of the Electric Power Industry (CRIEPI) has developed a method for the extraction of this water through the use of dimethyl ether (DME), which liquefies at ordinary temperatures under the influence of a slight pressure. In this method, the water content in the fuel is extracted into the liquefied DME for separation from the fuel. After dewatering, the DME is depressurised, and subsequently vaporised, thereby leaving the separated water. Dewatering with an input energy of only 1109 kJ/kg water under ordinary conditions has been demonstrated theoretically.

  17. Pulsed-field ionization electron spectroscopy and binding energies of alkali metal-dimethyl ether and -dimethoxyethane complexes.

    Science.gov (United States)

    Sohnlein, Bradford R; Li, Shenggang; Fuller, Jason F; Yang, Dong-Sheng

    2005-07-01

    Lithium and sodium complexes of dimethyl ether (DME) and dimethoxyethane (DXE) were produced by reactions of laser-vaporized metal atoms with organic vapors in a pulsed nozzle cluster source. The mono-ligand complexes were studied by photoionization and pulsed field ionization zero electron kinetic energy (ZEKE) spectroscopy. Vibrationally resolved ZEKE spectra were obtained for Li(DME), Na(DME) and Li(DXE) and a photoionization efficiency spectrum for Na(DXE). The ZEKE spectra were analyzed by comparing with the spectra of other metal-ether complexes and with electronic structure calculations and spectral simulations. Major vibrations measured for the M(DME) (M=Li,Na) ions were M-O and C-O stretches and M-O-C and C-O-C bends. These vibrations and additional O-Li-O and O-C-C-O bends were observed for the Li(DXE) ion. The M(DME) complexes were in C2v symmetry with the metal atom binding to oxygen, whereas Li(DXE) was in a C2 ring configuration with the Li atom attaching to both oxygen atoms. Moreover, the ionization energies of these complexes were measured from the ZEKE or photoionization spectra and bond dissociation energies were derived from a thermodynamic cycle.

  18. Dimethyl Ether (DME); Le Dimethyl Ether (DME)

    Energy Technology Data Exchange (ETDEWEB)

    NONE

    2006-07-01

    Total is an active participant in research to develop new gas-to-liquids (GTL) processes to obtain automotive fuel, olefins and other liquids from natural gas. Among the various processes for chemical conversion of natural gas, direct synthesis of DME destroys the least amount of gas, making it highly efficient. The thermal efficiency of the process developed by Japan JFE is 65 to 70%, higher than the conventional Fischer Tropsch process. This document presents the researches and the program of Total on this process. (author)

  19. Safety in Operation and Management of Dimethyl Ether Storage Tanks%二甲醚储罐的安全运行及管理

    Institute of Scientific and Technical Information of China (English)

    王峰

    2011-01-01

    对二甲醚储罐区进行危险辨识及事故后果模拟分析.从安全风险和运行管理的角度,进一步阐述了加强管理、确保二甲醚储罐安全运行与管理的具体措施.%A simulation analysis is carried out of hazard identification and accident consequences in a dimethyl ether storage tank farm. From the point of safety risks and operation management further explanation is given of specific measures for intensification of management and assurance of safety operation and management of the dimethyl ether storage tanks.

  20. Synthesis of dimethyl ether and alternative fuels in the liquid phase from coal-derived synthesis gas

    Energy Technology Data Exchange (ETDEWEB)

    Underwood, R.P.

    1993-01-01

    As part of the DOE-sponsored contract Synthesis of Dimethyl Ether and Alternative Fuels in the Liquid Phase from Coal-Derived Syngas'' experimental evaluations of the one-step synthesis of alternative fuels were carried out. The objective of this work was to develop novel processes for converting coal-derived syngas to fuels or fuel additives. Building on a technology base acquired during the development of the Liquid Phase Methanol (LPMEOH) process, this work focused on the development of slurry reactor based processes. The experimental investigations, which involved bench-scale reactor studies, focused primarily on three areas: (1) One-step, slurry-phase syngas conversion to hydrocarbons or methanol/hydrocarbon mixtures using a mixture of methanol synthesis catalyst and methanol conversion catalyst in the same slurry reactor. (2) Slurry-phase conversion of syngas to mixed alcohols using various catalysts. (3) One-step, slurry-phase syngas conversion to mixed ethers using a mixture of mixed alcohols synthesis catalyst and dehydration catalyst in the same slurry reactor. The experimental results indicate that, of the three types of processes investigated, slurry phase conversion of syngas to mixed alcohols shows the most promise for further process development. Evaluations of various mixed alcohols catalysts show that a cesium-promoted Cu/ZnO/Al[sub 2]O[sub 3] methanol synthesis catalyst, developed in Air Products' laboratories, has the highest performance in terms of rate and selectivity for C[sub 2+]-alcohols. In fact, once-through conversion at industrially practical reaction conditions yielded a mixed alcohols product potentially suitable for direct gasoline blending. Moreover, an additional attractive aspect of this catalyst is its high selectivity for branched alcohols, potential precursors to iso-olefins for use in etherification.

  1. Mechanisms and kinetics of noncatalytic ether reaction in supercritical water. 2. Proton-transferred fragmentation of dimethyl ether to formaldehyde in competition with hydrolysis.

    Science.gov (United States)

    Nagai, Yasuharu; Matubayasi, Nobuyuki; Nakahara, Masaru

    2005-04-28

    Noncatalytic reaction pathways and rates of dimethyl ether (DME) in supercritical water are determined in a tube reactor made of quartz according to liquid- and gas-phase 1H and 13C NMR observations. The reaction is studied at two concentrations (0.1 and 0.5 M) in supercritical water at 400 degrees C and over a water-density range of 0.1-0.6 g/cm3. The supercritical water reaction is compared with the neat one (in the absence of solvent) at 0.1 M and 400 degrees C. DME is found to decompose through (i) the proton-transferred fragmentation to methane and formaldehyde and (ii) the hydrolysis to methanol. Formaldehyde from reaction (i) is consecutively subjected to four types of redox reactions. Two of them proceed even without solvent: (iii) the unimolecular proton-transferred decarbonylation forming hydrogen and carbon monoxide and (iv) the bimolecular self-disproportionation generating methanol and carbon monoxide. When the solvent water is present, two additional paths are open: (v) the bimolecular self-disproportionation of formaldehyde with reactant water, producing methanol and formic acid, and (vi) the bimolecular cross-disproportionation between formaldehyde and formic acid, yielding methanol and carbonic acid. Methanol is produced through the three types of disproportionations (iv)-(vi) as well as the hydrolysis (ii). The presence of solvent water decelerates the proton-transferred fragmentation of DME; the rate constant is reduced by 40% at 0.5 g/cm3. This is caused by the suppression of low-frequency concerted motion corresponding to the reaction coordinate for the simultaneous C-O bond scission and proton transfer from one methyl carbon to the other. In contrast to the proton-transferred fragmentation, the hydrolysis of DME is markedly accelerated by increasing the water density. The latter becomes more important than the former in supercritical water at densities greater than 0.5 g/cm3.

  2. Calculations for the properties and reactions of the NH, PH, and AsH counterparts of dimethyl ether and acetone.

    Science.gov (United States)

    Wiberg, Kenneth B

    2014-11-21

    The properties and reactions of compounds in which the O of dimethyl ether or acetone has been replaced by NH, PH, or AsH have been studied computationally using CBS-QB3, CBS-APNO, G4, and W1BD. The properties include the bond dissociation energies and ionization potentials, and the reactions include those with with protons, methyl cations, and lithium cations. The effect on keto-enol equilibria also was examined. In all cases there was good agreement with the available experimental data. The agreement between these methods suggests that the least computationally costly model (CBS-QB3) should be of general use in studying organic compounds. The double-bond dissociation enthalpies of CH2═XHn were linearly related to those of the corresponding CH3-XHn+1 single bonds with a slope of 2.5. With the exception of C-C, the order corresponded to the electronegativity of X, suggesting that the differences are largely determined by internal Coulombic interactions. The differences in the electronegativities of the heteroatoms are largely responsible for the differences in the properties and reactions. Oxygen has a significantly higher electronegativity than the others, and as a result, the oxygen-substituted compounds are often different than the others.

  3. Mathematical Simulation and Design of Three-Phase Bubble Column Reactor for Direct Synthesis of Dimethyl Ether from Syngas

    Institute of Scientific and Technical Information of China (English)

    Dianhua Liu; Xing Hua; Dingye Fang

    2007-01-01

    A three-phase reactor mathematical model was set up to simulate and design a three-phase bubble column reactor for direct synthesis of dimethyl ether (DME) from syngas, considering both the influence of part inert carrier backmixing on transfer and the influence of catalyst grain sedimentation on reaction. On the basis of this model, the influences of the size and reaction conditions of a 100000 t/a DME reactor on capacity were investigated. The optimized size of the 10000 t/a DME synthesis reactor was proposed as follows: diameter 3.2 m, height 20 m, built-in 400 tube heat exchanger (φ 38×2 mm),and inert heat carrier paraffin oil 68 t and catalyst 34.46 t. Reaction temperature and pressure were important factors influencing the reaction conversion for different size reactors. Under the condition of uniform catalyst concentration distribution, higher pressure and temperature were proposed to achieve a higher production capacity of DME. The best ratio of fresh syngas for DME synthesis was 2.04.

  4. Selective inhibition of ammonium oxidation and nitrification-linked N2O formation by methyl fluoride and dimethyl ether

    Science.gov (United States)

    Miller, L.G.; Coutlakis, M.D.; Oremland, R.S.; Ward, B.B.

    1993-01-01

    Methyl fluoride (CH3F) and dimethyl ether (DME) inhibited nitrification in washed-cell suspensions of Nitrosomonas europaea and in a variety of oxygenated soils and sediments. Headspace additions of CH3F (10% [vol/vol]) and DME (25% [vol/vol]) fully inhibited NO2- and N2O production from NH4+ in incubations of N. europaea, while lower concentrations of these gases resulted in partial inhibition. Oxidation of hydroxylamine (NH2OH) by N. europaea and oxidation of NO2- by a Nitrobacter sp. were unaffected by CH3F or DME. In nitrifying soils, CH3F and DME inhibited N2O production. In field experiments with surface flux chambers and intact cores, CH3F reduced the release of N2O from soils to the atmosphere by 20- to 30-fold. Inhibition by CH3F also resulted in decreased NO3- + NO2- levels and increased NH4+ levels in soils. CH3F did not affect patterns of dissimilatory nitrate reduction to ammonia in cell suspensions of a nitrate- respiring bacterium, nor did it affect N2O metabolism in denitrifying soils. CH3F and DME will be useful in discriminating N2O production via nitrification and denitrification when both processes occur and in decoupling these processes by blocking NO2- and NO3- production.

  5. Study on proton-conducting solid oxide fuel cells with a conventional nickel cermet anode operating on dimethyl ether

    Science.gov (United States)

    Liu, Yu; Guo, Youmin; Wang, Wei; Su, Chao; Ran, Ran; Wang, Huanting; Shao, Zongping

    This study investigates dimethyl ether (DME) as a potential fuel for proton-conducting SOFCs with a conventional nickel cermet anode and a BaZr 0.4Ce 0.4Y 0.2O 3-δ (BZCY4) electrolyte. A catalytic test demonstrates that the sintered Ni + BZCY4 anode has an acceptable catalytic activity for the decomposition and steam reforming of DME with CO, CH 4 and CO 2 as the only gaseous carbon-containing products. An O 2-TPO analysis demonstrates the presence of a large amount of coke formation over the anode catalyst when operating on pure DME, which is effectively suppressed by introducing steam into the fuel gas. The selectivity towards CH 4 is also obviously reduced. Peak power densities of 252, 280 and 374 mW cm -2 are achieved for the cells operating on pure DME, a DME + H 2O gas mixture (1:3) and hydrogen at 700 °C, respectively. After the test, the cell operating on pure DME is seriously cracked whereas the cell operating on DME + H 2O maintains its original integrity. A lower power output is obtained for the cell operating on DME + H 2O than on H 2 at low temperature, which is mainly due to the increased electrode polarization resistance. The selection of a better proton-conducting phase in the anode is critical to further increase the cell power output.

  6. A criterion based on computational singular perturbation for the construction of reduced mechanism for dimethyl ether oxidation

    Directory of Open Access Journals (Sweden)

    Wu Zuozhu

    2013-01-01

    Full Text Available A criterion based on the computational singular perturbation (CSP method is proposed in order to determine the number of quasi-steady state (QSS species. This criterion is employed for the reduction of a detailed chemical kinetics mechanism for the oxidation of dimethyl ether (DME, involving 55 species and 290 reactions, leading to a 20 steps reduced mechanism which involves 26 species. A software package, named I-CSP, was developed to make the reduction process algorithmic. Input to the I-CSP includes (i the detailed mechanism, (ii the numerical solution of the problem for a specific set of operating conditions, (iii the number of quasi steady state (QSS species. The resulting reduced mechanism was validated both in homogenous reactor, including auto-ignition and PSR, over a wide range of pressures and equivalence ratios, and in a one-dimensional, unstretched, premixed, laminar steady DME/Air flame. Comparison of the results calculated with the detailed and the reduced mechanisms shows excellent agreement in the case of homogenous reactor, but discrepancies can be observed in the case of the premixed laminar flame.

  7. Why (1 0 0) terraces break and make bonds: oxidation of dimethyl ether on platinum single-crystal electrodes.

    Science.gov (United States)

    Li, Hongjiao; Calle-Vallejo, Federico; Kolb, Manuel J; Kwon, Youngkook; Li, Yongdan; Koper, Marc T M

    2013-09-25

    A surface structural preference for (1 0 0) terraces of fcc metals is displayed by many bond-breaking or bond-making reactions in electrocatalysis. Here, this phenomenon is explored in the electrochemical oxidation of dimethyl ether (DME) on platinum. The elementary C-O bond-breaking step is identified and clarified by combining information obtained from single-crystal experiments and density functional theory (DFT) calculations. Experiments on Pt(1 0 0), Pt(5 1 0), and Pt(10 1 0) surfaces show that the surface structure sensitivity is due to the bond-breaking step, which is unfavorable on step sites. DFT calculations suggest that the precursor for the bond-breaking step is a CHOC adsorbate that preferentially adsorbs on a square ensemble of four neighboring atoms on Pt(1 0 0) terraces, named as "the active site". Step sites fail to strongly adsorb CHOC and are, therefore, ineffective in breaking C-O bonds, resulting in a decrease in activity on surfaces with increasing step density. Our combined experimental and computational results allow the formulation of a new mechanism for the electro-oxidation of DME as well as a simple general formula for the activity of different surfaces toward electrocatalytic reactions that prefer (1 0 0) terrace active sites.

  8. Effect of Dimethyl Ether Co-feed on Catalytic Performance of Methane Dehydroaromatization over Mo/HZSM-5 Catalyst

    Institute of Scientific and Technical Information of China (English)

    Huiying Chen; Yonggang Li; Wenjie Shen; Yide Xu; Xinhe Bao

    2004-01-01

    The effect of dimethyl ether (DME) co-feed on the catalytic performance of methane dehy droaromatization (MDA) over 6Mo/HZSM-5 catalyst was investigated as a function of DME concentration under reaction conditions of T=1023 K, p=101 kPa and SV=1500 ml/(g·h). A high benzene yield was obtained and the stability of the catalyst was improved by adding 1.5%DME to the CH4 feed. The C6H6 yield was as high as ca. 10% even after reaction for 6 h. The stability of the catalyst was further improved when DME concentration in the co-feed gas was increased to an appropriate value.TGA and TPO results of the used 6Mo/HZSM-5 catalyst showed that the amount of coke on the used catalyst was reduced and the chemical nature of the coke was changed. When 1.5%DME was added to the CH4 feed, the coke formed on the catalyst could be burned off more easily than that when only CH4 was used as reactant.It is supposed that the oxygen in DME may play a role in preventing the coke burnt off at lower temperature from transforming into the coke burnt off at higher temperature, which results in the improvement of the stability of the catalyst.

  9. Effect of surface hydroxyls on dimethyl ether synthesis over the γ-Al₂O₃ in liquid paraffin: a computational study.

    Science.gov (United States)

    Zuo, Zhi-Jun; Wang, Le; Han, Pei-de; Huang, Wei

    2013-11-01

    In a recent paper (Zuo et al., Appl Catal A 408:130-136, 2011), the mechanism of dimethyl ether (DME) synthesis from methanol dehydration over γ-Al2O3 (110) was studied using density functional theory (DFT). Using the same method, the effect of surface hydroxyls on γ-Al2O3 in liquid paraffin during DME synthesis from methanol dehydration is investigated. It is found that DME is mainly formed from two adsorbed CH3O groups via methanol dehydrogenation on both dehydrated and hydrated γ-Al2O3 in liquid paraffin. No close correlation between catalytic activity and acid intensity was found. Before and after water adsorption at typical catalytic conditions (e.g., 553 K), the reaction rate is not obviously changed on γ-Al2O3(100) surface in liquid paraffin, but the reaction rate decreases by about 11 times on the (110) in liquid paraffin. Considering the area of the (110) and (100) surfaces under actual conditions, the catalytic activity decreased mainly because the Al3 sites on the (110) surface gradually become inactive. Catalytic activity decreased mainly due to surface hydrophilicity. The calculated results were consistent with the experiment.

  10. Attrition resistant catalyst for dimethyl ether synthesis in fluidized-bed reactor

    Institute of Scientific and Technical Information of China (English)

    Li-hua TENG

    2008-01-01

    Fluidized-bed reactor is a candidate for dimethyi ether(DME)synthesis from syngas because of its excellent heat removal capability.In Order to improve the attrition resistance of catalyst,an amount of silica sol as binder was added to the catalyst composed of methanol synthesis component CuO/ZnO/Al2O3 and methanol dehydration component HZSM-5,which was prepared by coprecipitation and shaped by spray drying to get spherical particles.The effect of silica sol on the catalytic activity was investigated in a fixed-bed flow microreactor.Based on the experiment results,silica sol in the range of 0~20wt% had small effect on the catalytie activity.Generally,the CO conversion and DME yield decreased with the increase in concen.tration of silica sol,while the attrition resistance of catalysts increased with increasing silica sol,indicating that it was feasible to improve the attrition resistance without greatly sacrificing the activity of catalyst.In addition,the characterizations of catalysts were carried out using Brunauer-Emmett-Teller(BET),X-ray powder diffraction(XRD)and temperature programmed reduction (TPR).

  11. Reaction of dimethyl ether with hydroxyl radicals: kinetic isotope effect and prereactive complex formation.

    Science.gov (United States)

    Bänsch, Cornelie; Kiecherer, Johannes; Szöri, Milan; Olzmann, Matthias

    2013-09-05

    The kinetic isotope effect of the reactions OH + CH3OCH3 (DME) and OH + CD3OCD3 (DME-d6) was experimentally and theoretically studied. Experiments were carried out in a slow-flow reactor at pressures between 5 and 21 bar (helium as bath gas) with production of OH by laser flash photolysis of HNO3 and time-resolved detection of OH by laser-induced fluorescence. The temperature dependences of the rate coefficients obtained can be described by the following modified Arrhenius expressions: k(OH+DME) = (4.5 ± 1.3) × 10(-16) (T/K)(1.48) exp(66.6 K/T) cm(3) s(-1) (T = 292-650 K, P = 5.9-20.9 bar) and k(OH+DME-d6) = (7.3 ± 2.2) × 10(-23) (T/K)(3.57) exp(759.8 K/T) cm(3) s(-1) (T = 387-554 K, P = 13.0-20.4 bar). A pressure dependence of the rate coefficients was not observed. The agreement of our experimental results for k(OH+DME) with values from other authors is very good, and from a fit to all available literature data, we derived the following modified Arrhenius expression, which reproduces the values obtained in the temperature range T = 230-1500 K at pressures between 30 mbar and 21 bar to better than within ±20%: k(OH+DME) = 8.45 × 10(-18) (T/K)(2.07) exp(262.2 K/T) cm(3) s(-1). For k(OH+DME-d6), to the best of our knowledge, this is the first experimental study. For the analysis of the reaction pathway and the kinetic isotope effect, potential energy diagrams were calculated by using three different quantum chemical methods: (I) CCSD(T)/cc-pV(T,Q)Z//MP2/6-311G(d,p), (II) CCSD(T)/cc-pV(T,Q)Z//CCSD/cc-pVDZ, and (III) CBS-QB3. In all three cases, the reaction is predicted to proceed via a prereaction OH-ether complex with subsequent intramolecular hydrogen abstraction and dissociation to give the methoxymethyl radical and water. Overall rate coefficients were calculated by assuming a thermal equilibrium between the reactants and the prereaction complex and by calculating the rate coefficients of the hydrogen abstraction step from canonical transition state theory

  12. Synthesis of nanocrystalline γ-Al2O3 by sol-gel and precipitation methods for methanol dehydration to dimethyl ether

    Institute of Scientific and Technical Information of China (English)

    Zahra Hosseini; Majid Taghizadeh; Fereydoon Yaripour

    2011-01-01

    The capability of sol-gel and conventional precipitation techniques for the synthesis of nanocrystalline γ-alumina was investigated.These catalysts were used for vapor-phase dehydration of methanol to dimethyl ether in a fixed-bed reactor under the same operating conditions (T= 300℃,P=1 bar,LHSV = 2.8,11.7,26.1 h-1)and characterized by means of N2 adsorption-desorption,NH3-TPD,XRD,TGA and SEM techniques.According to the experimental results,the catalysts prepared using sol-gel method in non-aqueous medium showed better performance compared with those prepared by other methods.

  13. Phosphate-Doped Carbon Black as Pt Catalyst Support: Co-catalytic Functionality for Dimethyl Ether and Methanol Electro-oxidation

    DEFF Research Database (Denmark)

    Yin, Min; Huang, Yunjie; Li, Qingfeng

    2014-01-01

    Niobium-phosphate-doped (NbP-doped) carbon blacks were prepared as the composite catalyst support for Pt nanoparticles. Functionalities of the composite include intrinsic proton conductivity, surface acidity, and interfacial synergistic interactions with methanol and dimethyl ether (DME......). The supported Pt catalysts show significant improvement in catalytic activity towards the direct oxidation of methanol and DME, attributable to the enhanced adsorption and dehydrogenation of methanol and DME, as well as the presence of activated OH species in the catalysts. The latter is demonstrated...

  14. QM/MM molecular dynamics study of the potential of mean force for the association of K{sup +} with dimethyl ether in aqueous solution

    Energy Technology Data Exchange (ETDEWEB)

    Thompson, M.A. [Pacific Northwest Lab., Richland, WA (United States)

    1995-11-15

    We present a hybrid Quantum Mechanical/Molecular Mechanical (QM/MM) molecular dynamics study of the free energy profile for the association of K{sup +} with dimethyl ether (DME) in H{sub 2}O. We calculate a potential of mean force and find a weak solvent separated ion-dipole pair (SSIDP) at 5.4 A separation and a contact ion-dipole (CIDP) free energy minimum at 2.7 A separation of the K{sup +} with the oxygen of DME. The latter distance agrees well with the gas-phase optimized K{sup +}/DME structure. This study demonstrates the nonadditive interactions of a solvated cation with a simple monodentate organic ligand. These results are useful for interpreting K{sup +} complexation by multidentate ligands, such as the crown ethers. 36 refs., 4 figs., 1 tab.

  15. Dimethyl Ether Injection Studies

    DEFF Research Database (Denmark)

    Sorenson, Spencer C.; Glensvig, Michael; Abata, Duane L.

    1998-01-01

    effects of DME in high pressure injection have also been observed. DME has a higher compressibility than diesel fuel, resulting in larger pressure oscillations in the injection system during the injection process. The oscillations with DME also have a slower delay rate than those of diesel fuel......A series of preliminary investigations has been performed in order to investigate the behavior of DME in a diesel injection environment. These studies have in-cluded visual observations of the spray penetration and angles for high pressure injection into Nitrogen using conventional jerk pump...... in the same system. As a first attempt to simulate combustion of DME in Diesel engines, the results of the spray studies have been incorporated into a simplified spray combustion model. A turbulent jet structure was adjusted to fit the penetration rates of the observed sprays. The observed spray widths agreed...

  16. (Liquid + liquid) and (liquid + solid) equilibrium of aqueous two-phase systems containing poly ethylene glycol di-methyl ether 2000 and di-sodium hydrogen phosphate

    Energy Technology Data Exchange (ETDEWEB)

    Zafarani-Moattar, Mohammed Taghi, E-mail: zafarani47@yahoo.co [Physical Chemistry Department, University of Tabriz, Tabriz 51664 (Iran, Islamic Republic of); Nasiri, Saeed [Physical Chemistry Department, University of Tabriz, Tabriz 51664 (Iran, Islamic Republic of)

    2010-09-15

    (Liquid + liquid) equilibrium (LLE) for the {l_brace}poly ethylene glycol di-methyl ether 2000 (PEGDME{sub 2000}) + Na{sub 2}HPO{sub 4} + H{sub 2}O{r_brace} system have been determined experimentally at T = (298.15, 308.15, 313.15, and 318.15) K. The effects of temperature on the binodals and tie-lines for the investigated aqueous two-phase system (ATPS) have been studied. An empirical non-linear expression developed by Merchuk was used for reproducing the experimental binodal data. In this work, the three fitting parameters of the Merchuk equation were obtained with the temperature dependence expressed in the linear form with (T - T{sub 0}) K as a variable. Furthermore, the modified local composition segment-based NRTL and Wilson models and also osmotic virial equation were used to describe the LLE data of the studied system. Also, the effects of the type of salt on LLE are discussed. In addition, the effects of end groups of the polymers PEGDME{sub 2000} and poly ethylene glycol 2000 on phase forming ability were studied. The complete phase diagram for the poly ethylene {l_brace}glycol di-methyl ether 2000 (PEGDME{sub 2000}) + Na{sub 2}HPO{sub 4} + H{sub 2}O{r_brace} system has also been determined at T = 298.15 K.

  17. Review on Standards for Liquefied Petroleum Gas and Dimethyl Ether%液化石油气、二甲醚产品标准述评

    Institute of Scientific and Technical Information of China (English)

    吴世逵; 江禄森; 陈智裕; 李坚; 陈世泰

    2013-01-01

    The key content about our country current effectively national standards and industry standards of liquefied petroleum gas and dimethyl ether products was introduced. The currently effective products’standards of liquefied petroleum gas and dimethyl ether including national standards, industrial standards and part of provinces and cities’DME/LPG composite fuel standards have promoted the development of gas industry. And they have also laid a solid foundation for implementing national standards of DME/LPG composite fuel.%介绍了我国现行有效的液化石油气、二甲醚产品的国家标准、行业标准的关键内容。现行有效的液化石油气、二甲醚产品的国家标准、行业标准以及部分省市DME与LPG复合燃料的地方标准推动了燃气产业发展,为DME与LPG复合燃料国家标准的发布实施奠定了坚实基础。

  18. Preparation of HZSM-5 membrane packed CuO-ZnO-Al2O3 nanoparticles for catalysing carbon dioxide hydrogenation to dimethyl ether

    Science.gov (United States)

    Liu, Rong; Tian, Haifeng; Yang, Aimei; Zha, Fei; Ding, Jian; Chang, Yue

    2015-08-01

    Spherical carbons were prepared successfully from aqueous glucose using hydrothermal method. After covered with aqueous Cu2+, Zn2+ and Al3+ ions during the co-precipitation treatment, carbons were removed via calcination to yield CuO-ZnO-Al2O3 nanoparticles. HZSM-5 membrane, which was synthesized using tetrapropylammonium hydroxide as templating agent, was packed onto CuO-ZnO-Al2O3 nanoparticles hydrothermally to form HZSM-5 packed CuO-ZnO-Al2O3 nanoparticles. It was characterized by the method of X-ray powder diffraction (XRD), scanning electronic microscopy (SEM), transmission electron microscopy (TEM), thermogravimetric analysis (TGA), and nitrogen sorption measurement. HZSM-5 packed CuO-ZnO-Al2O3 nanoparticles were used as catalysts for the CO2 hydrogenation to dimethyl ether. The catalyst activity was investigated in a fixed-bed reactor. Under the reaction conditions of pressure at 3.0 MPa, space velocity (SV) of 1800 mL gcat-1 h-1, volume ratio of CO2/H2 to 1:3 and temperature at 270 °C, the conversion of CO2 could reach to 48.3%, with a dimethyl ether yield and selectivity of 23.4% and 48.5%, respectively.

  19. Direct injection of dimethyl ether into a diesel engine with low-pressure common-rail injection system; Direkteinspritzung von Dimethylether in einen Dieselmotor mit Niederdruck-Common-Rail-Einspritzsystem

    Energy Technology Data Exchange (ETDEWEB)

    Janicke, D. [Wissenschaftlich-Technisches-Zentrum fuer Motoren- und Maschinenforschung gGmbH, Rosslau (Germany)

    2005-07-01

    Alternative fuels from renewables are viewed as fuels for the future. The contribution investigates dimethyl ether, which is a liquid gas with low emissions. Its physical and chemical properties require a specially designed fuelling system, which was constructed and tested. The system has piezo-controlled common rail injectors. The function was problem-free, with the advantages of soot-free combustion, short combustion times and low emissions. Fuel-induced wear was not observed. Especially in sensitive areas, dimethyl ether is an interesting alternative to conventional fuels. (orig.)

  20. Improvement and Application of the Detection Method of Dimethyl Ether%二甲醚检测方法的改进及其应用

    Institute of Scientific and Technical Information of China (English)

    林国新; 朱国军

    2016-01-01

    现行二甲醚组分检测的方法有HG/T 3934-2007《二甲醚》、 CJ/T 259-2007《城镇燃气用二甲醚》。在气雾剂类产品运用这些检测方法时,容易把产品配方中的甲醇误认作二甲醚,从而导致结果严重超标。作者通过改良色谱柱填充物,采取增加聚乙二醇600油酸酯固定液得到的色谱柱进行检测,并对气相色谱操作条件进行合理的优化调整,结果甲醇与二甲醚在流过色谱柱后分离效果理想,完全可以将甲醇与二甲醚分开。%The current methods used to analysis the dimethyl ether are HG/T 3934-2007“Dimethyl Ether” and CJ/T 259-2007 “Dimethyl Ether Used as Town Gas”. Methanol, within the formula of aerosol products, is frequently mistaken for DME by applying the analytical methods mentioned above, and because of these, the analytical results usually exceed the limitation greatly. The experimental data achieved by author showed that methanol and DME was able to completely separate after they flow through chromatographic column if we increased the polyglycol 600 oleic acid ester level within the stationary liquid of the gas chromatographic packed columns, and adjusted the operating conditions of the current analytical methods.

  1. 二甲醚生产工艺技术路线进展%Advanced of Dimethyl Ether Production Process Routes

    Institute of Scientific and Technical Information of China (English)

    宋彩霞; 田广华

    2012-01-01

    二甲醚可以用于替代LPG,用作民用燃气,还可以替代柴油用作汽车燃料等领域。目前工业上生产二甲醚主要有甲醇脱水和合成气直接合成两种工艺,本文对合成气一步法和甲醇脱水法的各工艺技术路线进行了论述。%Dimethyl ether can be used for household fuel instead of LPG, and as an alternative to diesel used for vehicle fuel. At present, dehydration of methanol and synthesis gas direct synthesis, the two main process routes of the industrial production of DME, were discussed.

  2. Negative catalytic effect of water on the reactivity of hydrogen abstraction from the C-H bond of dimethyl ether by deuterium atoms through tunneling at low temperatures

    Science.gov (United States)

    Oba, Yasuhiro; Watanabe, Naoki; Kouchi, Akira

    2016-10-01

    We report an experimental study on the catalytic effect of solid water on the reactivity of hydrogen abstraction (H-abstraction) from dimethyl ether (DME) in the low-temperature solid DME-H2O complex. When DME reacted with deuterium atoms on a surface at 15-25 K, it was efficiently deuterated via successive tunneling H-abstraction and deuterium (D)-addition reactions. The 'effective' rate constant for DME-H2O + D was found to be about 20 times smaller than that of pure DME + D. This provides the first evidence that the presence of solid water has a negative catalytic effect on tunneling H-abstraction reactions.

  3. Phase behavior of mixtures of polyoxyethylene(10) stearyl ether (Brij-76), 1-butanol, isooctane, and mixed polar solvents I. Water and formamide (or N,N-dimethyl formamide).

    Science.gov (United States)

    Nandy, Debdurlav; Mitra, Rajib K; Paul, Bidyut K

    2006-08-01

    The isothermal phase diagram of the quaternary system polyoxyethylene(10) stearyl ether (Brij-76)/1-butanol/isooctane/water has been constructed at 30 degrees C with equal amounts of oil and water. A regular fishtail diagram was obtained, confirming the establishment of hydrophile-lipophile balance (HLB) in the system. Mixing of formamide (FA) [or N,N-dimethyl formamide (DMF)] with water as a cosolvent altered the HLB and decreased the solubilization capacity of the quaternary system. No three-phase body appeared at high FA or DMF content. Similar observations were noted for temperature-induced phase diagrams. The effect of DMF was more pronounced than that of FA in reducing the maximum solubilization capacity. The results have been summarized on the basis of HLB and mutual solubility of the components.

  4. Pore-structure-mediated hierarchical SAPO-34: Facile synthesis, tunable nanostructure, and catalysis applications for the conversion of dimethyl ether into olefins

    Institute of Scientific and Technical Information of China (English)

    Yu Cui; Qiang Zhang; Jie He; Yao Wang; Fei Wei

    2013-01-01

    Hierarchical cross-like SAPO-34 catalysts with different pore size distributions were obtained via hydrothermal synthesis with polyethylene glycol (PEG) as the mesopore-generating agent.The hierarchical SAPO-34 molecular sieves were characterized using X-ray diffraction,scanning electron microscopy,N2 adsorption-desorption,thermogravimetric analysis,and temperature-programmed NH3 desorption.The cross-like SAPO-34 catalysts exhibited enriched multi-porosity,and the sizes of their mesopores ranged from 10 to 50 nm.Both the mesoporous structures and morphologies of the hierarchical SAPO-34 could be further tuned through adjustments of the amount of PEG used.The as-obtained SAPO-34 showed dramatic catalytic performance in the conversion of dimethyl ether into olefins.A maximum selectivity of olefins of 96% was achieved,which was attributed to the rapid transport of the reactants and products in zeolitic micropores through mesopores.

  5. On the Formation of the C2H6O Isomers Ethanol (C2H5OH) and Dimethyl Ether (CH3OCH3) in Star-forming Regions

    Science.gov (United States)

    Bergantini, Alexandre; Maksyutenko, Pavlo; Kaiser, Ralf I.

    2017-06-01

    The structural isomers ethanol (CH3CH2OH) and dimethyl ether (CH3OCH3) were detected in several low-, intermediate-, and high-mass star-forming regions, including Sgr B2, Orion, and W33A, with the relative abundance ratios of ethanol/dimethyl ether varying from about 0.03 to 3.4. Until now, no experimental data regarding the formation mechanisms and branching ratios of these two species in laboratory simulation experiments could be provided. Here, we exploit tunable photoionization reflectron time-of-flight mass spectrometry (PI-ReTOF-MS) to detect and analyze the production of complex organic molecules (COMs) resulting from the exposure of water/methane (H2O/CH4) ices to energetic electrons. The main goal is to understand the formation mechanisms in star-forming regions of two C2H6O isomers: ethanol (CH3CH2OH) and dimethyl ether (CH3OCH3). The results show that the experimental branching ratios favor the synthesis of ethanol versus dimethyl ether (31 ± 11:1). This finding diverges from the abundances observed toward most star-forming regions, suggesting that production routes on interstellar grains to form dimethyl ether might be missing; alternatively, ethanol can be overproduced in the present simulation experiments, such as via radical-radical recombination pathways involving ethyl and hydroxyl radicals. Finally, the PI-ReTOF-MS data suggest the formation of methylacetylene (C3H4), ketene (CH2CO), propene (C3H6), vinyl alcohol (CH2CHOH), acetaldehyde (CH3CHO), and methyl hydroperoxide (CH3OOH), in addition to ethane (C2H6), methanol (CH3OH), and CO2 detected from infrared spectroscopy. The yield of all the confirmed species is also determined.

  6. Process simulation of dimethyl ether distillation unit%二甲醚精馏装置的模拟与分析

    Institute of Scientific and Technical Information of China (English)

    白孜杨; 马宏方; 张海涛; 应卫勇; 房鼎业

    2011-01-01

    二甲醚精馏是甲醇制二甲醚工艺中的重要工段.本文应用PRO/Ⅱ流程模拟软件,采用PR方程计算气相组分的逸度系数,利用NRTL法计算液相活度系数,实现了对二甲醚精馏过程的流程模拟.在操作压力为0.83 MPa下,考察了年产20万吨甲醇气相脱水制二甲醚工艺中二甲醚精馏塔进料温度、原料进料位置和回流比对二甲醚分离效果的影响.模拟结果和实际操作数据吻合良好,可用于指导生产装置的改造和设计.%Dimethyl ether (DME) distillation unit is one of the very important part of methanol to DME. PRO/II process simulation software is applied to simulate the process that annual output of 20 tons methanol dehydration to DME. In the operating pressure of 0.83 Mpa, material feed temperature, material feed location, reflux ratio was analyzed based on NRTL-PR thermodynamic model. Its application shows that the simulation result is in good accordance with actual operation data. This confirms the accuracy of the analogy method which we adopted on Dimethyl Ether distillation unit. It can be used to guide the production equipment transformation and design.

  7. Preparation of HZSM-5 membrane packed CuO–ZnO–Al{sub 2}O{sub 3} nanoparticles for catalysing carbon dioxide hydrogenation to dimethyl ether

    Energy Technology Data Exchange (ETDEWEB)

    Liu, Rong; Tian, Haifeng; Yang, Aimei; Zha, Fei, E-mail: zhafei@nwnu.edu.cn; Ding, Jian; Chang, Yue

    2015-08-01

    Highlights: • CuO–ZnO–Al{sub 2}O{sub 3} composite nanoparticles were successfully prepared using carbon sphere as template. • HZSM-5@CuO–ZnO–Al{sub 2}O{sub 3} capsule catalyst was prepared hydrothermally. • Zeolite capsule catalysts exhibited an extremely good selectivity for DME compared with the conventional hybrid catalyst. - Abstract: Spherical carbons were prepared successfully from aqueous glucose using hydrothermal method. After covered with aqueous Cu{sup 2+}, Zn{sup 2+} and Al{sup 3+} ions during the co-precipitation treatment, carbons were removed via calcination to yield CuO–ZnO–Al{sub 2}O{sub 3} nanoparticles. HZSM-5 membrane, which was synthesized using tetrapropylammonium hydroxide as templating agent, was packed onto CuO–ZnO–Al{sub 2}O{sub 3} nanoparticles hydrothermally to form HZSM-5 packed CuO–ZnO–Al{sub 2}O{sub 3} nanoparticles. It was characterized by the method of X-ray powder diffraction (XRD), scanning electronic microscopy (SEM), transmission electron microscopy (TEM), thermogravimetric analysis (TGA), and nitrogen sorption measurement. HZSM-5 packed CuO–ZnO–Al{sub 2}O{sub 3} nanoparticles were used as catalysts for the CO{sub 2} hydrogenation to dimethyl ether. The catalyst activity was investigated in a fixed-bed reactor. Under the reaction conditions of pressure at 3.0 MPa, space velocity (SV) of 1800 mL g{sub cat}{sup −1} h{sup −1}, volume ratio of CO{sub 2}/H{sub 2} to 1:3 and temperature at 270 °C, the conversion of CO{sub 2} could reach to 48.3%, with a dimethyl ether yield and selectivity of 23.4% and 48.5%, respectively.

  8. 甲醇气相脱水制二甲醚的催化剂%Catalyst for dehydration of methanol to dimethyl ether

    Institute of Scientific and Technical Information of China (English)

    杨玉旺; 戴清; 刘敬利

    2013-01-01

    Pseudo-boehmite was synthesized by neutralization of aluminium nitrate with ammonia water, and then used as the raw material to prepare the catalyst for dehydration of methanol to dimethyl ether. The precipitation pH, reaction temperature in the pseudo-boehmite synthesis process and calcination temperature in catalyst preparation that influenced the performance of catalyst in dehydration of methanol to dimethyl ether were investigated. The results indicated that at precipitation pH8.0±0.2, reaction temperature 50~60 ℃, and calcination temperature 550~650 ℃, the catalyst had the best activity. Modifying the catalyst with SiO2, SO42-, PO43- improved further catalytic activity.%采用硝酸铝和氨水中和方法得到拟薄水铝石为原料,制备了甲醇制二甲醚催化剂.考察拟薄水铝石制备过程中的中和pH值、中和温度以及催化剂制备过程中的煅烧温度对甲醇气相脱水制二甲醚性能的影响.结果表明,当中和pH值在8.0±0.2、中和温度为50~60℃以及煅烧温度在550~600℃时得到的甲醇制二甲醚催化剂活性最高.通过在催化剂上添加SiO2、SO42-、PO43-等对甲醇脱水催化剂进行改性表明,改性后甲醇脱水催化剂活性有明显的提高.

  9. Review on Detection Standards for Liquefied Petroleum Gas and Dimethyl Ether%液化石油气、二甲醚检测方法述评

    Institute of Scientific and Technical Information of China (English)

    陈智裕; 江禄森; 李坚; 陈世泰; 吴世逵

    2013-01-01

    Current valid determination LPG, DME standard methods included GB/T 10410-2008“artificial gas and liquefied petroleum gas composition by gas chromatographic analysis constants”, SH/T 0230-1992 liquefied petroleum gas composition determination (chromatography France), SH/T 1483-2004“industrial isobutylene oxygenates by gas chromatography”. Liquefied petroleum gas and dimethyl ether product standards (national standards or enterprise standards) also provided for the use of liquefied petroleum gas and dimethyl ether detection methods. These test methods were recommended and chromatography. Many improved methods were reported in the literatures. According to the need of socio-economic development and the development of DME industry, It was necessary to study the introduction of arbitration could be used for LPG and DME testing standards.%  现行有效测定液化石油气、二甲醚组分的标准方法有GB/T 10410-2008《人工煤气和液化石油气常量组分气相色谱分析方法》、SH/T 0230-1992液化石油气组成测定法(色谱法)、SH/T 1483-2004《工业异丁烯中含氧化合物的测定气相色谱法》,液化石油气、二甲醚产品标准(国家标准或企业标准)中也规定了所采用的液化石油气、二甲醚检测方法。这些检测方法都是推荐性的,均为色谱法,文献也报道了许多改进方法。根据社会经济发展需要和二甲醚产业发展情况,有必要研究出台可用于仲裁的液化石油气、二甲醚检测标准。

  10. Modeling of Bubble Column Slurry Reactor for Dimethyl Ether Synthesis from Syngas%合成气制二甲醚三相淤浆床反应器的数学模型研究

    Institute of Scientific and Technical Information of China (English)

    张海涛; 应卫勇; 房鼎业

    2005-01-01

    A mathematical model for a bubble column slurry reactor is presented for dimethyl ether synthesis from syngas. Methanol synthesis from carbon monoxide and carbon dioxide by hydrogenation and the methanol dehydration are considered as independent reactions, in which methanol, dimethyl ether and carbon dioxide are the key components. In this model, the gas phase is considered to be in plug flow and the liquid phase to be in partly back mixing with axial distribution of solid catalyst. The simulation results show that the axial dispersion of solid catalysts, the operational height of the slurry phase in the bubble column slurry reactor, and the reaction results are influenced by the reaction temperature and pressure, which are the basic data for the scale-up of reactor.

  11. 由合成气生产二甲醚过程反应协同作用的研究%Study on Synergy Effect in Dimethyl Ether Synthesis from Syngas

    Institute of Scientific and Technical Information of China (English)

    2001-01-01

    Influence of reaction temperature, pressure and space velocity on the direct synthesis of dimethyl ether (DME) from syngas is studied in an isothermal fixed-bed reactor. The catalyst is a physical mixture of C301 copper-based methanol (MeOH) synthesis catalyst and ZSM-5 dehydration catalyst. The experimental results show that the chemical synergy between methanol synthesis reaction and methanol dehydration reaction is evident. The conversion of carbon monoxide is over 90%.``

  12. Experimental investigation into the oxidation reactivity and nanostructure of particulate matter from diesel engine fuelled with diesel/polyoxymethylene dimethyl ethers blends

    Science.gov (United States)

    Yang, Hao; Li, Xinghu; Wang, Yan; Mu, Mingfei; Li, Xuehao; Kou, Guiyue

    2016-11-01

    This paper focuses on oxidation reactivity and nanostructural characteristics of particulate matter (PM) emitted from diesel engine fuelled with different volume proportions of diesel/polyoxymethylene dimethyl ethers (PODEn) blends (P0, P10 and P20). PM was collected using a metal filter from the exhaust manifold. The collected PM samples were characterized using thermogravimetric analysis (TGA), scanning electron microscopy (SEM), transmission electron microscopy (TEM) and Raman spectroscopy. The TGA results indicated that the PM produced by P20 had the highest moisture and volatility contents and the fastest oxidation rate of solid carbon followed by P10 and P0 derived PM. SEM analysis showed that PM generated from P20 was looser with a lower mean value than PM emitted from P10 and P0. Quantitative analysis of high-resolution TEM images presented that fringe length was reduced along with increased separation distance and tortuosity with an increase in PODEn concentration. These trends improved the oxidation reactivity. According to Raman spectroscopy data, the intensity, full width at half-maximum and intensity ratio of the bands also changed demonstrating that PM nanostructure disorder was correlated with a faster oxidation rate. The results show the use of PODEn affects the oxidation reactivity and nanostructure of PM that is easier to oxidize.

  13. Chemical recycling of carbon dioxide to methanol and dimethyl ether: from greenhouse gas to renewable, environmentally carbon neutral fuels and synthetic hydrocarbons.

    Science.gov (United States)

    Olah, George A; Goeppert, Alain; Prakash, G K Surya

    2009-01-16

    Nature's photosynthesis uses the sun's energy with chlorophyll in plants as a catalyst to recycle carbon dioxide and water into new plant life. Only given sufficient geological time can new fossil fuels be formed naturally. In contrast, chemical recycling of carbon dioxide from natural and industrial sources as well as varied human activities or even from the air itself to methanol or dimethyl ether (DME) and their varied products can be achieved via its capture and subsequent reductive hydrogenative conversion. The present Perspective reviews this new approach and our research in the field over the last 15 years. Carbon recycling represents a significant aspect of our proposed Methanol Economy. Any available energy source (alternative energies such as solar, wind, geothermal, and atomic energy) can be used for the production of needed hydrogen and chemical conversion of CO(2). Improved new methods for the efficient reductive conversion of CO(2) to methanol and/or DME that we have developed include bireforming with methane and ways of catalytic or electrochemical conversions. Liquid methanol is preferable to highly volatile and potentially explosive hydrogen for energy storage and transportation. Together with the derived DME, they are excellent transportation fuels for internal combustion engines (ICE) and fuel cells as well as convenient starting materials for synthetic hydrocarbons and their varied products. Carbon dioxide thus can be chemically transformed from a detrimental greenhouse gas causing global warming into a valuable, renewable and inexhaustible carbon source of the future allowing environmentally neutral use of carbon fuels and derived hydrocarbon products.

  14. Dimethyl ether synthesis from CO2 hydrogenation on La-modified CuO-ZnO-Al2O3/HZSM-5 bifunctional catalysts

    Institute of Scientific and Technical Information of China (English)

    GAO Wengui; WANG Hua; WANG Yuhao; GUO Wei; JIA Miaoyao

    2013-01-01

    A series of CuO-ZnO-A12O3-La2Oy/HZSM-5 bifunctional catalysts with various La loadings for dimethyl ether (DME) directly synthesized from CO2 hydrogenation were prepared.The catalysts were characterized with N2 adsorption-desorption,X-ray diffraction (XRD),H2 temperature-programmed reduction (H2-TPR),NH3 temperature-programmed desorption (NH3-TPD) and N2O titration techniques,and tested for the synthesis of DME directly from CO2 hydrogenation in a fixed-bed reactor.The results showed that the reducibility,dispersion ofbifunctional catalysts were strongly dependent on the addition of La.With the addition of appropriate amount of La,the crystallite size of CuO was decreased and the dispersion of Cu on the surface was enhanced,which resulted in the increased conversion of CO2.It was also found that the selectivity to DME was related to the intensity and amount of strong acid site on the catalyst surface.The presence of La favored the production of DME,and the optimum catalytic activity was obtained when the amount of La was 2.0 wt.%.

  15. Dimethyl ether synthesis via methanol and syngas over rare earth metals modified zeolite Y and dual Cu-Mn-Zn catalysts

    Energy Technology Data Exchange (ETDEWEB)

    Dingfeng Jin; Bing Zhu; Zhaoyin Hou; Jinhua Fei; Hui Lou; Xiaoming Zheng [Zhejiang University, Hangzhou (China). Institute of Catalysis, Department of Chemistry

    2007-12-15

    A series of zeolite Y modified with La, Ce, Pr, Nd, Sm and Eu were prepared via ion-exchange, and characterized by XRD, FT-IR and NH{sub 3}-TPD. It was found that these rare earth metals were encapsulated in the supercage of zeolite Y and resulted in its enhanced acidity. Among them, La-, Ce-, Pr- and Nd-modified zeolite Y exhibited higher activity and stability (than pure HY) for methanol dehydration to dimethyl ether (DME). For DME synthesis directly from CO hydrogenation using the dual Cu-Mn-Zn/modified-Y catalysts, it was found that Cu-Mn-Zn/La-Y and Cu-Mn-Zn/Ce-Y were more active than Cu-Mn-Zn/pure-HY. The conversion of CO on Cu-Mn-Zn/Ce-HY achieved 77.1% in an isothermal fixed bed reactor at 245{sup o}C, 2.0 MPa, H{sub 2}/CO = 3/2 and 1500 h{sup -1}. 36 refs., 7 figs., 3 tabs.

  16. Optimization of hydrothermal synthesis of H-ZSM-5 zeolite for dehydration of methanol to dimethyl ether using full factorial design

    Institute of Scientific and Technical Information of China (English)

    Samaneh Hosseini; Majid Taghizadeh; Ali Eliassi

    2012-01-01

    H-ZSM-5 zeolite was synthesized by hydrothermal method.The effects of different synthesis parameters,such as hydrothermal crystallization temperature (170-190 ℃) and Si/Al molar ratio (100-150),on the catalytic performance of the dehydration of methanol to dimethyl ether (DME) over the synthesized H-ZSM-5 zeolite were studied.The catalysts were characterized by N2 adsorption-desorption,XRD,NH3-TPD,TGA/DTA,and SEM techniques.The full factorial design of experiments was applied to the synthesis of H-ZSM-5 zeolite and the effects of synthesis conditions and their interaction on the yield of DME as the response variable were determined.Analysis of variance showed that two variables and their interaction significantly affected the response.According to the experimental results,the optimized catalyst prepared at 170 ℃ with the Si/Al molar ratio of 100 showed the best catalytic performance among the tested H-ZSM-5 zeolite.

  17. Composition of reaction intermediates for stoichiometric and fuel-rich dimethyl ether flames: flame-sampling mass spectrometry and modeling studies.

    Science.gov (United States)

    Wang, Juan; Chaos, Marcos; Yang, Bin; Cool, Terrill A; Dryer, Fred L; Kasper, Tina; Hansen, Nils; Osswald, Patrick; Kohse-Höinghaus, Katharina; Westmoreland, Phillip R

    2009-03-07

    Molecular-beam synchrotron photoionization mass spectrometry and electron-ionization mass spectrometry are used for measurements of species mole fraction profiles for low-pressure premixed dimethyl ether (DME) flames with equivalence ratios ranging from near-stoichiometric conditions (Phi = 0.93) to fuel-rich flames near the limits of flat-flame stability (Phi = 1.86). The results are compared with predictions of a recently modified kinetic model for DME combustion [Zhao et al., Int. J. Chem. Kinet., 2008, 40, 1-18] that has been extensively tested against laminar flame speed measurements, jet-stirred reactor experiments, pyrolysis and oxidation experiments in flow reactors, species measurements for burner-stabilized flames and ignition delay measurements in shock tubes. The present comprehensive measurements of the composition of reaction intermediates over a broad range of equivalence ratios considerably extends the range of the previous experiments used for validation of this model and allows for an accurate determination of contributions of individual reactions to the formation or destruction of any given flame species. The excellent agreement between measurements and predictions found for all major and most intermediate species over the entire range of equivalence ratios provides a uniquely sensitive test of details of the kinetic model. The dependence on equivalence ratio of the characteristic reaction paths in DME flames is examined within the framework of reaction path analyses.

  18. Quantification of the Keto-Hydroperoxide (HOOCH2OCHO) and Other Elusive Intermediates during Low-Temperature Oxidation of Dimethyl Ether.

    Science.gov (United States)

    Moshammer, Kai; Jasper, Ahren W; Popolan-Vaida, Denisia M; Wang, Zhandong; Bhavani Shankar, Vijai Shankar; Ruwe, Lena; Taatjes, Craig A; Dagaut, Philippe; Hansen, Nils

    2016-10-04

    This work provides new temperature-dependent mole fractions of elusive intermediates relevant to the low-temperature oxidation of dimethyl ether (DME). It extends the previous study of Moshammer et al. [ J. Phys. Chem. A 2015 , 119 , 7361 - 7374 ] in which a combination of a jet-stirred reactor and molecular beam mass spectrometry with single-photon ionization via tunable synchrotron-generated vacuum-ultraviolet radiation was used to identify (but not quantify) several highly oxygenated species. Here, temperature-dependent concentration profiles of 17 components were determined in the range of 450-1000 K and compared to up-to-date kinetic modeling results. Special emphasis is paid toward the validation and application of a theoretical method for predicting photoionization cross sections that are hard to obtain experimentally but essential to turn mass spectral data into mole fraction profiles. The presented approach enabled the quantification of the hydroperoxymethyl formate (HOOCH2OCH2O), which is a key intermediate in the low-temperature oxidation of DME. The quantification of this keto-hydroperoxide together with the temperature-dependent concentration profiles of other intermediates including H2O2, HCOOH, CH3OCHO, and CH3OOH reveals new opportunities for the development of a next-generation DME combustion chemistry mechanism.

  19. Partial oxidation of dimethyl ether using the structured catalyst Rh/Al2O3/Al prepared through the anodic oxidation of aluminum.

    Science.gov (United States)

    Yu, B Y; Lee, K H; Kim, K; Byun, D J; Ha, H P; Byun, J Y

    2011-07-01

    The partial oxidation of dimethyl ether (DME) was investigated using the structured catalyst Rh/Al2O3/Al. The porous Al2O3 layer was synthesized on the aluminum plate through anodic oxidation in an oxalic-acid solution. It was observed that about 20 nm nanopores were well developed in the Al2O3 layer. The thickness of Al2O3 layer can be adjusted by controlling the anodizing time and current density. After pore-widening and hot-water treatment, the Al2O3/Al plate was calcined at 500 degrees C for 3 h. The obtained delta-Al2O3 had a specific surface area of 160 m2/g, making it fit to be used as a catalyst support. A microchannel reactor was designed and fabricated to evaluate the catalytic activity of Rh/Al2O3/Al in the partial oxidation of DME. The structured catalyst showed an 86% maximum hydrogen yield at 450 degrees C. On the other hand, the maximum syngas yield by a pack-bed-type catalyst could be attained by using a more than fivefold Rh amount compared to that used in the structured Rh/Al2O3/Al catalyst.

  20. Enzyme-like specificity in zeolites: a unique site position in mordenite for selective carbonylation of methanol and dimethyl ether with CO.

    Science.gov (United States)

    Boronat, Mercedes; Martínez-Sánchez, Cristina; Law, David; Corma, Avelino

    2008-12-03

    The mechanism of methanol carbonylation at different positions of zeolite MOR is investigated by quantum-chemical methods in order to discover which are the active sites that can selectively catalyze the desired reaction. It is shown that when methanol carbonylation competes with hydrocarbon formation, the first reaction occurs preferentially within 8MR channels. However, the unique selectivity for the carbonylation of methanol and dimethyl ether in mordenite is not only due to the size of the 8MR channel: neither process occurs equally at the two T3-O31 and T3-O33 positions. We show that only the T3-O33 positions are selective and that this selectivity is due to the unusual orientation of the methoxy group in relation to the 8MR channel (parallel to the cylinder axis). Only in this situation does the transition state for the attack of CO fit perfectly in the 8MR channel, while the reaction with methanol or DME is sterically impeded. This result explains why T3-O31, while also located in the 8MR channel of mordenite, is not as selective as the T3-O33 position and why ferrierite, although it contains 8MR channels, is less selective than mordenite. The competing effect of water is explained at the molecular level, and the molecular microkinetic reaction model has been established.

  1. Ring-polymer molecular dynamics studies on the rate coefficient of the abstraction channel of hydrogen plus ethane, propane, and dimethyl ether

    Science.gov (United States)

    Meng, Qingyong; Chen, Jun

    2017-01-01

    To accurately compute the rates of the abstraction channels of hydrogen plus ethane (Et), propane (Pr), and dimethyl ether (DME), ring-polymer molecular dynamics (RPMD) method is used in conjunction with the recently constructed local permutation invariant polynomial neural-networks potential energy surface of the parent H + CH4 system [Q. Meng et al., J. Chem. Phys. 144, 154312 (2016)]. For H + Et, one of the H atoms in CH4 of the parent system is replaced by a methyl group, while for the H + DME reaction, it is replaced by the methoxyl group. For the H + Pr reaction, replacing one of the H atoms in CH4 by an ethyl group, the terminal channel is built, meanwhile the middle channel is considered through replacing two H atoms in CH4 by two methyl groups. Since the potential energy barriers of the title reactions must differ from the H + CH4 barrier, the corrections have to be made by computing the ratio of free-energy barriers between H + CH4 and the title reactions at coupled cluster with a full treatment singles and doubles (where the triples contribution is calculated by perturbation theory, that is, CCSD(T)) level. Comparing the present RPMD rates with the previous theoretical and experimental results, good agreement can be found. Moreover, probable reasons for the deviation between the present RPMD rates and the previous experimental ones are discussed.

  2. Quantification of the Keto-Hydroperoxide (HOOCH2OCHO) and Other Elusive Intermediates during Low-Temperature Oxidation of Dimethyl Ether

    KAUST Repository

    Moshammer, Kai

    2016-09-17

    This work provides new temperature-dependent mole fractions of elusive intermediates relevant to the low-temperature oxidation of dimethyl ether (DME). It extends the previous study of Moshammer et al. [ J. Phys. Chem. A 2015, 119, 7361–7374] in which a combination of a jet-stirred reactor and molecular beam mass spectrometry with single-photon ionization via tunable synchrotron-generated vacuum-ultraviolet radiation was used to identify (but not quantify) several highly oxygenated species. Here, temperature-dependent concentration profiles of 17 components were determined in the range of 450–1000 K and compared to up-to-date kinetic modeling results. Special emphasis is paid toward the validation and application of a theoretical method for predicting photoionization cross sections that are hard to obtain experimentally but essential to turn mass spectral data into mole fraction profiles. The presented approach enabled the quantification of the hydroperoxymethyl formate (HOOCH2OCH2O), which is a key intermediate in the low-temperature oxidation of DME. The quantification of this keto-hydroperoxide together with the temperature-dependent concentration profiles of other intermediates including H2O2, HCOOH, CH3OCHO, and CH3OOH reveals new opportunities for the development of a next-generation DME combustion chemistry mechanism.

  3. 合成气一步法制二甲醚分离工艺流程优化模拟%Optimization simulation of separation process of dimethyl ether synthesized by one-step method from syngas

    Institute of Scientific and Technical Information of China (English)

    郭晓艳; 孙兰义

    2013-01-01

    In order to obtain dimethyl ether synthesized by one-step method from syngas,a technological process was put forward that dimethyl ether was absorbed with water firstly,then absorption liquid was separated by means of two distillation columns.Optimization simulation of three separation process flows has been made with chemical process simulation software-Aspen plus,and NRTL thermodynamic model was adopted.The influence of temperature,operating pressure,liquid-gas ratio and number of stages on the absorption rate of dimethyl ether were discussed.Finally 40 ℃,1.5 Mpa,liquid-gas ratio of 1.5 and the number of theoretical plate of l0 were adopted in the absorption tower.There were three methods of separating dimethyl ether from absorption liquid.The first method was that CO2 was separated from the top of one ditillation tower,and dimethyl ether,methanol and water separated from the bottom firstly,then through another column dimethyl ether and methanol were separated.The second method was that CO2 and dimethyl ether were separated from the top of the column,and CO2 released as noncondensable gas,methanol and water separated from the bottom.The third way is that CO2 was separated from the top of the column,dimethyl ether separated by means of lateral extractions,and methanol and water separated from the bottom.Simulation of these three flows has been made on the same number of stages,operating pressure and reflux ratio.And the results showed that recovery rate for dimethyl ether of the first method reached 91.1% and concentration of product reached 0.9996,higher than the values of two other methods and literature.But the temperature at the top of this column was-15.1 ℃,and water cannot be used as a cooling medium,which can increase the operation cost of the tower.So the appropriate separation process of dimethyl ether should be determined through comprehensive economic calculation that combined with the recovery rate and operation cost of the product.In this paper

  4. Literature Research Report of Polyoxymethylene Dimethyl Ethers Synthyesis%聚甲氧基二烷基醚合成文献调研报告

    Institute of Scientific and Technical Information of China (English)

    李臻; 宋河远

    2016-01-01

    聚甲氧基二甲醚是一类分子式为CH3O(CH2O)nCH3(简写DMMn,n≥1)的醚类化合物,含氧量高(42%~51%)且具有高的十六烷值(>30),能改善柴油的燃烧性能减少排放,因而被认为是理想的柴油含氧添加物。特别是当n=3~8时,DMM3-8具有与柴油相近的性质,平均十六烷值>76,按20%与柴油调和,碳烟和NOx的排放能分别降低80%~90%和50%。DMMn分子中间为低分子量甲醛缩聚物,两端由甲基封端,通常由提供甲基的化合物,如甲醇,二甲醚和甲缩醛,和提供低聚甲醛的化合物,如甲醛,三聚甲醛和多聚甲醛,反应得到。因此,实现从甲醇到DMMn的转化不仅能延长甲醇产业链,消耗过剩的甲醇产能,而且有利于节能减排目标的实现。在早期,以硫酸或者盐酸为催化剂,催化甲醇和甲醛、多聚甲醛或者二氧戊烷反应合成DMMn。BASF公司采用H2SO4或者CF3SO3H为催化剂,甲醇、DMM、三聚甲醛和多聚甲醛为原料得到DMM1-10,但是催化剂腐蚀严重,而且原料转化率和DMM3-8的选择性都很低。BP公司采用分子筛或者酸性树脂为催化剂,通过复杂的工艺实现二甲醚和甲醛转化为DMMn,但是,产物中DMM3-8低于10%。近年来,中科院兰州化物所开展了离子液体催化甲醇和三聚甲醛反应合成DMM3-8的研究,产品单程收率达到50%,DMM3-8选择性大于70%。%Polyoxymethylene dimethyl ethers are a kind of ether compounds with the formula CH3O(CH2O)nCH3(abbreviated to DMMn, n≥1). DMMn has high oxygen content (42%~51%) with a high cetane number (>30) and is regarded as a promising diesel additive, which can improve the combustibility of the diesel oil, enhance the efficiency of combustion, and reduce the release of pollutants. Especially, DMM3-8 exhibits high oxygen content, moderate boiling points, excellent miscibility with diesel oil, and average cetane number of above 76; it was reported that by

  5. Rechargeable lithium battery using non-flammable electrolyte based on tetraethylene glycol dimethyl ether and olivine cathodes

    Science.gov (United States)

    Di Lecce, Daniele; Carbone, Lorenzo; Gancitano, Vincenzo; Hassoun, Jusef

    2016-12-01

    We propose lithium metal cells employing LiCF3SO3-tetraethylene glycol dimethy ether (TEGDME) electrolyte solution with LiFePO4 and LiMn0.5Fe0.5PO4 cathodes. The electrolyte is selected due to its non-flammability, herein demonstrated, and considered as a key requirement for application cells employing high energy lithium metal anode. The selected olivine cathodes, i.e., stable materials prepared by solvothermal pathway, have regular submicrometrical morphology suitable for cell operation and homogeneous composition, as confirmed by electron microscopy and energy dispersive X-ray spectroscopy. The electrochemical tests reveal promising cycling performances in terms of delivered capacity, stability and rate capability. The Li/LiCF3SO3-TEGDME/LiFePO4 cell operates at 3.5 V with capacity ranging from 150 mAh g-1 at C/10 to 110 mAh g-1 at 2C, while the Li/LiCF3SO3-TEGDME/LiFe0.5Mn0.5PO4 cell performs following two plateaus at 4.1 V and 3.5 V with capacity ranging from 160 mAh g-1 at C/10 to 75 mAh g-1 at 2C. Hence, the results demonstrate the suitability of TEGDME-based electrolytes in combination with LiFePO4 and LiFe0.5Mn0.5PO4 cathodes for high performances lithium battery.

  6. 二甲醚合成和精馏系统工艺优化设计%Process optimization and design for dimethyl ether synthesis and distillation

    Institute of Scientific and Technical Information of China (English)

    崔健

    2014-01-01

    Typical dimethyl ether (DME) production process by methanol dehydration was analyzed, and the irrationality in its process design and energy utilization was pointed out. Based on this, an optimized process for DME synthesis and distillation was put forward. PR-NRTL method was applied to process simulation, which was verified to be suitable for calculation of the process optimization through the comparison between calculation and operation data of practical plant. The results of optimized process showed that its consumption of steam and cooling water was reduced significantly when the DME product could meet the quality requirement. Cooling water saved about 12.4%, which achieved the goal of energy-saving.%对典型的甲醇脱水合成二甲醚工艺进行了系统分析,发现了其工艺设计和用能的不合理性,对合成和精馏工艺分别提出了优化设计。流程模拟计算使用 PR-NRTL 模型,并对实际运行装置进行了标定计算,证明了该模型的准确性和进行流程优化的可靠性。优化流程计算结果与原流程进行对比发现,在满足二甲醚产品质量要求下,蒸汽和冷却水消耗明显减少,冷却水节省了约12.4%,达到了节能优化的目的。

  7. A series of copper-free ternary oxide catalysts ZnAlCex used for hydrogen production via dimethyl ether steam reforming

    Science.gov (United States)

    Zhang, Lijie; Meng, Ming; Wang, Xiaojing; Zhou, Shuang; Yang, Lijuan; Zhang, Tianyong; Zheng, Lirong; Zhang, Jing; Hu, Tiandou

    2014-12-01

    Ce-substituted ternary oxide catalysts ZnAlCex were prepared and employed in dimethyl ether steam reforming (DME SR) to produce hydrogen. XRD, XAFS (XANES & EXAFS), H2O-TPD, CH3OH-TPD and TPSR techniques were used for catalyst characterization. It is found that the catalytic performance of these catalysts is dependent on Ce content. The catalyst containing 20 wt% CeO2 exhibits the best catalytic performance. Its calculated TOF (0.034 s-1) is nearly three times to that of ZnAlO. The kinetic results reveal that the addition of 20 wt% CeO2 to ZnAlCex greatly decreases the apparent activation energy (Ea) of DME SR, due to the formation of new reaction sites such as Ce4+-O-Zn2+ linkages. XRD and EXAFS analyses indicate that Ce addition can not only decrease the crystallite size of ZnO and ZnAl2O4, but also tune the relative contents of them. The results of H2O-TPD and CH3OH-TPD show that Ce addition can lower H2 desorption temperature, which accounts well for the better catalytic performance of ZnAlCex. It is worth noting that the Zn-based catalysts display much lower CO selectivity than the Cu-based one, especially the Ce-substituted ZnAlCex. Start-off durability tests demonstrate that this series of catalysts also possess high catalytic stability.

  8. Simultaneous small-angle neutron scattering and Fourier transform infrared spectroscopic measurements on cocrystals of syndiotactic polystyrene with polyethylene glycol dimethyl ethers1

    Science.gov (United States)

    Kaneko, Fumitoshi; Seto, Naoki; Sato, Shuma; Radulescu, Aurel; Schiavone, Maria Maddalena; Allgaier, Jürgen; Ute, Koichi

    2016-01-01

    Syndiotactic polystyrene (sPS) is a crystalline polymer which has a unique property; it is able to form cocrystals with a wide range of chemical compounds, in which the guest molecules are confined in the vacancies of the host sPS crystalline region. Recently, it has been found that even polyethylene glycol oligomers with a molecular weight of more than several hundreds can be introduced into the sPS crystalline region. It is quite important to know how such a long-chain molecule is stored in the host sPS lattice. To tackle this issue, a new simultaneous measurement method combing small-angle neutron scattering and Fourier transform infrared spectroscopy (SANS/FTIR), which has been recently developed by the authors, was applied to an sPS cocrystal with polyethylene glycol dimethyl ether with a molecular weight of 500 (PEGDME500). The temperature-dependent changes of the SANS profile and FTIR spectrum were followed from room temperature up to 413 K for a one-dimensionally oriented SANS/PEGDME500 cocrystal sample. The intensity of the reflections due to the stacking of crystalline lamellae showed a significant temperature dependence. The two-dimensional pattern in the high Q region of SANS also changed depending on temperature. The combined information obtained by SANS and FTIR suggested that PEGDME500 molecules are distributed in both the crystalline and amorphous regions in the low-temperature region close to room temperature, but they are predominantly included in the amorphous region in the high-temperature region. It was also suggested by the two-dimensional SANS profile that PEGDME500 molecules in the crystalline region have an elongated structure along the thickness direction of the crystalline lamellae. PMID:27738412

  9. Macrokinetic simulation of dimethyl ether synthesis in a slurry-bed reactor%浆态床合成二甲醚宏观动力学模拟

    Institute of Scientific and Technical Information of China (English)

    杨伟; 洪若瑜; 李洪钟

    2008-01-01

    采用宏观动力学,对以合成气为原料的浆态床液相法合成二甲醚反应进行模拟研究,通过物料恒算建立一组常微分方程组,计算过程采用四阶精度的Runge-Kutta法并结合C++编程求解.通过模拟计算,讨论了压力、温度、空速、催化剂浓度、CO2浓度对反应转化率、收率以及DME的选择性的影响,从而寻找合适的反应器参数,为实际的工业生产提供参考.%A one-dimensional homogeneous-phase model with detailed chemical reaction kinetics was used to simulate the synthesis of dimethyl ether (DME) from syngas directly in a slurry-bed reactor. The derived non-linear ordinary-differential equations were solved using the fourth-order Runge-Kutta numerical integration. The programming language C++was employed to implement the numerical algorithm. The influences of inlet pressure,reaction temperature,superficial gas velocity in the reactor,catalyst ratio and CO2 content of the feed gas on the CO conversion,DME yield and DME selectivity were studied. The optimal reaction conditions were found,which can be used for engineering scale-up and design.

  10. Influence of low-temperature combustion and dimethyl ether-diesel blends on performance, combustion, and emission characteristics of common rail diesel engine: a CFD study.

    Science.gov (United States)

    Lamani, Venkatesh Tavareppa; Yadav, Ajay Kumar; Narayanappa, Kumar Gottekere

    2017-06-01

    Due to presence of more oxygen, absence of carbon-carbon (C-C) bond in chemical structure, and high cetane number of dimethyl ether (DME), pollution from DME operated engine is less compared to diesel engine. Hence, the DME can be a promising alternative fuel for diesel engine. The present study emphasizes the effect of various exhaust gas recirculation (EGR) rates (0-20%) and DME/Diesel blends (0-20%) on combustion characteristics and exhaust emissions of common rail direct injection (CRDI) engine using three-dimensional computational fluid dynamics (CFD) simulation. Extended coherent flame model-3 zone (ECFM-3Z) is implemented to carry out combustion analysis, and k-ξ-f model is employed for turbulence modeling. Results show that in-cylinder pressure marginally decreases with employing EGR compared to without EGR case. As EGR rate increases, nitrogen oxide (NO) formation decreases, whereas soot increases marginally. Due to better combustion characteristics of DME, indicated thermal efficiency (ITE) increases with the increases in DME/diesel blend ratio. Adverse effect of EGR on efficiency for blends is less compared to neat diesel, because the anoxygenated region created due to EGR is compensated by extra oxygen present in DME. The trade-off among NO, soot, carbon monoxide (CO) formation, and efficiency is studied by normalizing the parameters. Optimum operating condition is found at 10% EGR rate and 20% DME/diesel blend. The maximum indicated thermal efficiency was observed for DME/diesel ratio of 20% in the present range of study. Obtained results are validated with published experimental data and found good agreement.

  11. Conversion of Dimethyl Ether to Branched Hydrocarbons Over Cu/BEA: the Roles of Lewis Acidic and Metallic Sites in H2 Incorporation

    Energy Technology Data Exchange (ETDEWEB)

    Hensley, Jesse E.; Schaidle, Joshua A.; Ruddy, Daniel A.; Cheah, Singfoong; Habas, Susan E.; Pan, Ming; Zhang, Guanghui; Miller, Jeffrey T.

    2017-04-26

    Conversion of biomass to fuels remains as one of the most promising approach to support our energy needs. It has been previously shown that the gasification of non-edible cellulosic biomass can be used to derive fuels like methanol and dimethyl ether (DME). However, the use of methanol and DME is limited due to the fact that they have low energy densities, poor lubricity and lower viscosity when compared to long-chain hydrocarbons. Increasing the blending percentage can also lead to undesired amounts of oxygenated molecules in the transportation fuel infrastructure, which restrict their applicability as jet or diesel fuels. Consequently, the petroleum-derived hydrocarbons remain as the main constituent of the middle-distillate based fuels. One way to increase the share of biofuels in middle-distillates is to use methanol/DME as building blocks for producing renewable, energy-dense hydrocarbons. One way to achieve this is by catalytically converting the DME and methanol to light olefins, followed by oligomerization to higher molecular weight premium alkanes, which can directly be used as kerosene/diesel fuels. Here, we report the catalytic dimerization of biomass-derived deoxygenated olefins into transportation fuel-range hydrocarbons under liquid-phase stirred-batch conditions. Specifically, the effect of operating conditions, such as reaction temperature, solvent-type, reaction duration and olefin-structure, on the conversion, selectivity and kinetics of dimerization of triptene (2,3,3-trimethyl-1-butene) were investigated. Triptene, as previously reported, is one of the major products of DME-homologation reaction over a BEA zeolite4. We show that triptene can be converted to high quality middle-distillates using a commercially available ion-exchange acid resin, Amberlyst-35 (dry) by the process of catalytic dimerization.

  12. Detection and Identification of the Keto-Hydroperoxide (HOOCH 2 OCHO) and Other Intermediates during Low-Temperature Oxidation of Dimethyl Ether

    KAUST Repository

    Moshammer, Kai

    2015-07-16

    In this paper we report the detection and identification of the keto-hydroperoxide (hydroperoxymethyl formate, HPMF, HOOCH2OCHO) and other partially oxidized intermediate species arising from the low-temperature (540 K) oxidation of dimethyl ether (DME). These observations were made possible by coupling a jet-stirred reactor with molecular-beam sampling capabilities, operated near atmospheric pressure, to a reflectron time-of-flight mass spectrometer that employs single-photon ionization via tunable synchrotron-generated vacuum-ultraviolet radiation. On the basis of experimentally observed ionization thresholds and fragmentation appearance energies, interpreted with the aid of ab initio calculations, we have identified HPMF and its conceivable decomposition products HC(O)O(O)CH (formic acid anhydride), HC(O)OOH (performic acid), and HOC(O)OH (carbonic acid). Other intermediates that were detected and identified include HC(O)OCH3 (methyl formate), cycl-CH2-O-CH2-O- (1,3-dioxetane), CH3OOH (methyl hydroperoxide), HC(O)OH (formic acid), and H2O2 (hydrogen peroxide). We show that the theoretical characterization of multiple conformeric structures of some intermediates is required when interpreting the experimentally observed ionization thresholds, and a simple method is presented for estimating the importance of multiple conformers at the estimated temperature (∼100 K) of the present molecular beam. We also discuss possible formation pathways of the detected species: for example, supported by potential energy surface calculations, we show that performic acid may be a minor channel of the O2 + CH2OCH2OOH reaction, resulting from the decomposition of the HOOCH2OCHOOH intermediate, which predominantly leads to the HPMF. © 2015 American Chemical Society.

  13. Study on the Effect of Adding Polyoxymethylene Dimethyl Ethers on Properties of Diesel Fuel%聚甲氧基二甲醚对柴油性质的影响

    Institute of Scientific and Technical Information of China (English)

    邓小丹; 韩冬云; 李秀萍; 李丹东; 孙旭东; 李玉阁

    2013-01-01

    Polyoxymethylene dimethyl ether is a new type of diesel fuel additive, which can improve combustion and reduce pollution emissions significantly. In the experiment, effect of adding polyoxymethylene dimethyl ether on properties of diesel fuel was studied. The results show that:adding 20%polyoxymethylene dimethyl ether can improve the quality of diesel oil, the pour point of the diesel oil can be reduced from 0 ℃ to -6 ℃, cetane number can be enhanced from 46 to 53.6 and flash point can be increased from 55 ℃ to 57 ℃. At the same time, other technical specifications of the diesel oil are in accordance with standard of 0# diesel fuel.%聚甲氧基二甲醚(PODE)是一种新型的柴油添加剂,能够改善燃烧,大幅度减少污染排放物。本文考察其与柴油不同配比对柴油性质的影响。结果表明:20%的混配柴油能够很好地改善柴油品质,将柴油凝点从0℃降至-6℃,十六烷值从46提高至53.6,以及闭口闪点从55℃升高至57℃,且其他技术指标符合0#柴油国标标准,这对我国的燃油发展有实际的应用意义。

  14. Far-infrared spectra of dimethyl-ether and its 13C enriched isotopologues: The fundamental band of the C-O-C in plane bending mode, ν7

    Science.gov (United States)

    Kutzer, P.; Weismann, D.; Waßmuth, B.; Pirali, O.; Roy, P.; Yamada, K. M. T.; Giesen, T. F.

    2016-11-01

    We recorded the ν7 fundamental band of dimethyl-ether around 400 cm-1 for the normal and 13C-enriched isotopologues using the Fourier transform spectrometer at the SOLEIL Synchrotron facility. For all three species P, Q and R branch-transitions up to J = 20 and Ka = 5 were assigned and the band origins and rotational parameters of Watson's A-reduced Hamiltonian have been determined by the least-squares fitting procedure. The line splitting due to the torsional tunneling is observed for low J transitions, which is attributed to the ro-vibrational interaction with the excited torsional states.

  15. Mechanisms underlying vasorelaxation induced in rat aorta by galetin 3,6-dimethyl ether, a flavonoid from Piptadenia stipulacea (Benth.) Ducke.

    Science.gov (United States)

    Macêdo, Cibério L; Vasconcelos, Luiz H C; de Correia, Ana C C; Martins, Italo R R; de Lira, Daysianne P; de O Santos, Bárbara V; de A Cavalcante, Fabiana; Silva, Bagnólia A da

    2014-11-27

    In this study, we investigated the relaxant action of galetin 3,6-dimethyl ether (FGAL) on rat aorta. The flavonoid relaxed both PMA‑ and phenylephrine (Phe)-induced contractions (pD2 = 5.36 ± 0.11 and 4.17 ± 0.10, respectively), suggesting the involvement of PKC and Phe pathways or α1 adrenergic receptor blockade. FGAL inhibited and rightward shifted Phe-induced cumulative contraction‑response curves, indicating a noncompetitive antagonism of α1 adrenergic receptors. The flavonoid was more potent in relaxing 30 mM KCl- than 80 mM KCl-induced contractions (pD2 = 5.50 ± 0.22 and 4.37 ± 0.12). The vasorelaxant potency of FGAL on Phe-induced contraction was reduced in the presence of 10 mM TEA+. Furthermore, in the presence of apamin, glibenclamide, BaCl2 or 4-AP, FGAL-induced relaxation was attenuated, indicating the participation of small conductance calcium-activated K+ channels (SKCa), ATP-sensitive K+ channels (KATP), inward rectifier K+ channels (Kir) and voltage-dependent K+ channels (KV), respectively. FGAL inhibited and rightward shifted CaCl2-induced cumulative contraction-response curves in both depolarizing medium (high K+) and in the presence of verapamil and phenylephrine, suggesting inhibition of Ca2+ influx through voltage-gated calcium channels (CaV) and receptor operated channels (ROCs), respectively. Likewise, FGAL inhibited Phe-induced contractions in Ca2+-free medium, indicating inhibition of Ca2+ release from the sarcoplasmic reticulum (SR). FGAL potentiated the relaxant effect of aminophylline and sildenafil but not milrinone, suggesting the involvement of phosphodiesterase V (PDE V). Thus, the FGAL vasorelaxant mechanism involves noncompetitive antagonism of α1 adrenergic receptors, the non-selective opening of K+ channels, inhibition of Ca2+ influx through CaV or ROCs and the inhibition of intracellular Ca2+ release. Additionally, there is the involvement of cyclic nucleotide pathway, particularly through PDE V inhibition.

  16. 二甲醚与合成气制备醋酸乙烯的研究%Synthesis of vinyl acetate from dimethyl ether and syngas

    Institute of Scientific and Technical Information of China (English)

    胡益共; 吕晓峰; 刘殿华; 房鼎业; 贾云; 冯成海; 高有智; 延建军; 黄向宏

    2015-01-01

    以二甲醚(DME)与合成气为原料,碘化铑、碘甲烷、醋酸锂、对甲苯磺酸为催化体系,醋酸为溶剂在高压反应釜中合成醋酸乙烯(VAC),考察了反应温度、反应时间、对甲苯磺酸用量、CO/H2物质的量比对反应的影响,最优条件为:反应温度180℃,对甲苯磺酸0.002mol,反应时间5h,CO/H2物质的量比为1,总压4.6MPa。最后建立了幂函数型VAC合成动力学模型,经统计学检验,计算值与实验值有较好的吻合性,表明该模型是合适的。%Synthesis of vinyl acetate (VAC) from dimethyl ether (DME) and syngas with acetic acid as solvent was carried out in a batch autoclave catalyzed by the system of rhodium iodide, methyl iodide, lithium acetate and p-toluenesulfonic acid. The effects of reaction temperature and time, p-toluenesulfonic acid dosage and CO/H2 mole ratio on the reaction were investigated, and the optimal condition was determind as follow:180℃, p-toluene sulfonic acid dosage of 0.002mol, reaction time of 5h and CO/H2 mole ratio of 1 with a total pressure of 4.6MPa. Finally, the reaction kinetic model of power function type was established according to the reaction mechanism of VAC synthesis from DME and syngas, and the statistical tests showed that the calculated values were consistent with the experimental values, which indicated that the model was appropriate.

  17. 甲醇气相脱水制二甲醚本征动力学研究%Intrinsic kinetics of methanol dehydration to dimethyl ether

    Institute of Scientific and Technical Information of China (English)

    张梁; 张玉柱; 潘强; 宋彩霞; 张海涛; 应卫勇; 房鼎业

    2011-01-01

    在温度240~340℃、压力0.1~1.0 MPa、液体体积空速0.9~4.0 h-1的等温积分反应器中,催化剂为甲醇脱水MD-2型催化剂,研究了甲醇脱水生成二甲醚的本征动力学,并考察了操作条件对甲醇转化率的影响。实验结果表明:随着温度的升高,甲醇转化率先升高后降低;压力的变化对甲醇转化率的影响不大;随着空速的增加,甲醇转化率逐渐降低。根据实验测定数据,应用参数估值方法,依据不同反应机理推导出以各组分逸度表示的4种双曲型动力学方程,残差分析及统计检验表明,基于Langmuir-Hinshelwood解离吸%The intrinsic kinetics of methanol dehydration to dimethyl ether and the effect of operation conditions on the conversion of methanol were carried out in an isothermal integral fixed bed reactor over catalyst MD-2.The experiments were performed on the temperature 240~340 ℃,pressures 0.1~1.0 MPa,and liquid space velocities 0.9~4.0 h-1.The results indicate that the methanol conversion first increases then decreases with increasing temperature;the pressure has little effect on the methanol conversion;the methanol conversion decreases with increasing space velocity.Four kinds of kinetic models expressing with each component's fugacity are established based on different reaction mechanism and by parameter estimation method according to the experimental data.The analysis of residual error and statistic test show that the intrinsic kinetic equation based on the mechanism of Langmuir-Hinshelwood dissociation adsorption is reliable.

  18. 2001~2011年我国二甲醚合成催化剂的文献分析%Bibliometric Analysis of Literature on the Catalyst Used in Preparing Dimethyl ether from 2001 to 2011 in China

    Institute of Scientific and Technical Information of China (English)

    李敏悦; 徐航

    2012-01-01

    Dimethyl ether (DME) is an important product DME preparation and becomes hot spot research. By using of coal chemical industry. DME catalyst is a key part in method of bibliometric analysis of literature,all literatures during 2001-2011 were searched with the key words of "dimethyl ether" and "catalyst" in Chinese National Knowledge Infrastructure (CNKI). To analyze the years of their publication, coauthors of the literatures, the areas of literatures,the found, the content and the journal. It was tried to reveal the recent development of more than ten years and future trend of DME industry.%二甲醚(DME)是煤化工领域中的一种重要产品,二甲醚催化剂因是合成DME的最关键部分而成为热点。以“二甲醚”和“催化剂”为关键词对CNKI数据库进行文献检索,将所得数据按年度、合著率、地区、基金项目、内容、期刊等方面进行统计与分析,试图揭示我国催化合成二甲醚研究领域最近十多年的发展现状和未来趋势。

  19. Study on separation of a new diesel fuel additive polyoxymethylene dimethyl ethers%新型柴油添加剂聚缩醛二甲醚的分离研究

    Institute of Scientific and Technical Information of China (English)

    胡国庆; 田恒水; 魏永梅; 黄婕

    2015-01-01

    利用萃取等方法处理原料,有效地减轻了塔堵塞和共沸夹带过多的问题。采用常‐减压精馏相结合的方法对聚缩醛二甲醚进行了分离,得到了各产物分离的较佳工艺条件。实验中得到了纯度(质量分数)分别为99.06%的甲缩醛、97.81%的二聚产物、99.68%的三聚产物以及99.62%的四聚产物,为工业化分离提纯聚缩醛二甲醚提供了基础依据。%The raw material was treated by extraction ,which effectively reduced the tower plug‐ging and azeotropic entrainment .Polyoxymethylene dimethyl ethers (PODE) were separated by at‐mospheric‐vacuum rectification and the optimal technical conditions of each product separation were a‐chieved .In the experiment ,the purity of each product reached methyl 99 .06% ,PODE2 97 .81% , PODE3 99 .68% ,and PODE4 99 .62% ,w hich could provide an experimental basis for industrial puri‐fication of polyoxymethylene dimethyl ethers .

  20. 三种二甲醚生产系统的流程模拟和3E评价%PROCESS SIMULATION AND 3E ASSESSMENT OF THREE DIMETHYL ETHER PRODUCTION SYSTEMS IN CHINA

    Institute of Scientific and Technical Information of China (English)

    姜立雪; 蒋晓隆; 麻林巍; 李政; 倪维斗

    2011-01-01

    对甲醇气相法合成二甲醚、煤气化制甲醇气相法合成二甲醚以及煤炭-风电联产甲醇制二甲醚的三种典型二甲醚生产系统进行了流程设计、模拟和能耗/CO2排放/经济成本的3E(Energy,Economic,Enviorenment)评价,并对影响二甲醚经济成本的敏感性因素(例如煤价、甲醇价格和风电设备利用小时数等)进行了敏感性分析.%This manuscript designed, simulated and carried 3E assessment of energy consumption, CO2 emission and economic cost of three dimethyl ether production systems in China,which are based on gas-phase methanol dehydration process (conventional process), gas-phase methanol dehydration integrated with coal gasification process (coal gasification process), and polygeneration process integrating coal gasification and wind power water dehydration (polygeneration process). And sensitivity analysis is performed on sensitive factors affecting the economic costs of dimethyl ether such as coal price, methanol price and equivalent capacity factor of coal-wind combined system.

  1. 三相搅拌釜反应器中二氧化碳加氢合成二甲醚%Synthesis of dimethyl ether from CO2+H2 in a three-phase agitated reactor

    Institute of Scientific and Technical Information of China (English)

    柯思明; 林荆

    2000-01-01

    Synthesis of dimethyl ether from carbon dioxide and hydrogen in a mechanical agi tated autoclave has been studied by using medical paraffin as inert liquid medium over hybrid catalyst composed of C302 catalyst for methanol synthesis and CM-3-1 catalyst for metha nol dehydration in the range of temperature 230~280℃、pressure 2~5MPa with the CO2:H2 rat io of feed gas at 1:3 and 1:4. The CO2 conversion and the selectivity of dimet hyl ether and methanol under various conditions were determined. The results sho wed that the proparation of two catalysts had effect on the reaction. When increasing CM-3-1, the CO2 conversion and selectivity of dimethyl ether increased.%在反应温度230~280℃、压力2~5MPa下,采用V(CO2)/V(H2)=1:3与1:4的原料气,以液态医用石蜡为惰性液相介质,使用 C302铜基催化剂和CM-3- 1改性分子筛组成复合催化剂,在搅拌釜反应器中研究CO2加H2合成二甲醚(DME),得到 不同反应条件下的CO2转化率、二甲醚与甲醇的选择性。结果表明两种催化剂的配比对反 应结果有影响,CM-3-1催化剂用量多时,反应转化率提高,二甲醚选择性提高。

  2. PROGRESS IN DIMETHYL ETHER SYNTHESIS TECHNIQUE BY ONE-STEP METHOD%二甲醚一步法合成技术进展

    Institute of Scientific and Technical Information of China (English)

    刘勇; 张杰杉; 曹宇

    2000-01-01

    As an important raw material for chemical industry and clean fuel,the dimethyl ether (DME) synthesis technique by one-step method has rapidly developed in recent years. As compared with two-step method, the production cost of DME by one-step method is low, which lays a foundation for extending its application scope. This paper expounds that the thermodynamic advantages of DME synthesized by one-step method as compared with that by two-step method stem from the coordinate effect engendered due to the many chemical reactions occurred at the same time. The thermodynamic advantages directly lead to raise of the synthetic gas convension rate. In this paper, the developing situation of two DME synthesis techniques by one-step method (slurry bed and fixed bed synthesis techniques)is summarized, the progress in these two techniques represented by NKK and Haldor Tops φe A/S companies and their industrialization course are described and the different requirements for these two techniques to the synthetic gas composition and gasproducing technology are preliminary discussed. Finally, in view of the different adaptabilities of the different gas-producing technologies, the suitable-to-adopt one-step method industrialization plan for producing DME is appraised in this paper in the light of the different requirements of the market.%近年来,二甲醚作为重要化工原料及清洁燃料,其一步法合成技术发展迅速。与两步法相比,二甲醚一步法生产成本的降低为其使用范围的扩大奠定了基础。本文阐述了二甲醚一步法合成较两步法合成在热力学上的优势来源于多个化学反应同时进行所产生的协同效应。热力学上的优势直接导致了原料合成气转化率的提高。综述了两种一步法二甲醚合成技术(浆床合成技术和固定床合成技术)的发展情况。对以NKK和HaldorTopsφe A/S两公司为代表的这两种技术的进展及工业化进程进行了描述,还就这两种

  3. 生物质气化合成二甲醚系统的火用分析%Exergy analysis of dimethyl ether synthesis via biomass gasification

    Institute of Scientific and Technical Information of China (English)

    陈露露; 肖军; 宋国辉; 卜寿珍; 沈来宏

    2014-01-01

    Based on the simulation of dimethyl ether (DME)synthesis from biomass gasification in interconnected fluidized beds using Aspen Plus,the exergy analysis of the DME synthesis system is performed.And the effects of operation parameters on the exergy efficiencies are studied.The re-sults show that the most exergy loss occurs in the gasification subsystem,and the system can reach the maximum exergy efficiency when the H2/CO molar ratio is about 2 .It is beneficial for the exer-gy efficiency of the liquefaction subsystem to improve conversion of syngas to DME by one-step and reduce the recycle gas ratio.In addition,the exergy loss of the whole system is mainly caused by the process irreversibility,and the internal exergy loss accounts for nearly 80% of all exergy loss.It is suggested that for the purpose of DME production,the operation parameters be controlled at a gasifica-tion temperature of 750 to 800 ℃,a steam and biomass ratio of 0.3,the liquefaction temperature of 260 to 280℃,and the liquefaction pressure of 4.0 to 4.5 MPa.And with the above-mentioned condi-tions,the yield of DME can reach 6.20 mol/kg and the total exergy efficiency can reach 51.66%.%基于生物质串行流化床气化合成二甲醚(DME)系统的Aspen Plus模拟,对系统进行热力学火用分析,研究了气化反应参数与合成反应参数对各子系统和总系统的火用效率影响.研究结果显示:火用损失主要发生在气化子系统中;气化产物氢碳摩尔比在2左右时,系统火用效率可达到最大;液化子系统提高气化合成二甲醚一步反应的有效转化率,降低循环气份额,可有效提高系统火用效率;全系统的火用损失主要是由过程的不可逆性引起的,内部火用损率近80%.对于稻秸气化一步法合成二甲醚系统,适宜的气化温度为750~800℃,水蒸气生物质质量比为0.3;在合成温度为260~280℃,合成压力为4.0~4.5 MPa的条件下,系

  4. Effects of ZrO2 on the Performance of CuO-ZnO-Al2O3/HZSM-5 Catalyst for Dimethyl Ether Synthesis from CO2 Hydrogenation

    Institute of Scientific and Technical Information of China (English)

    Yanqiao Zhao; Jixiang Chen; Jiyan Zhang

    2007-01-01

    A series of composite catalysts were prepared by the wet mixing method, and the mass ratio of CuO-ZnO-Al2O3-ZrO2 component to HZSM-5 zeolite (molar ratio of SiO2 to A12O3 being 25) was 2:1. The CuO-ZnO-Al2O3-ZrO2 (CuO/ZnO/Al2O3=3/6/l by weight) component was prepared by a modified 'two-step' co-precipitation method. The effects of ZrO2 on the performance of CuO-ZnO-Al2O3/HZSM-5 catalyst for dimethyl ether synthesis from CO2 hydrogenation were investigated. It was found that ZrO2 improved the properties of CuO-ZnO-Al2O3/HZSM-5 as a structural promoter.

  5. Enhanced catalytic performance for direct synthesis of dimethyl ether from syngas over a La2O3 modified Cu-ZrO2/γ-Al2O3 hybrid catalyst

    Institute of Scientific and Technical Information of China (English)

    Zhuo Li; Jianqing Li; Cheng Yang; Jinhu Wu

    2012-01-01

    A series of hybrid catalysts were made by physically mixing Cu-ZrO2 and γ-Al2O3,for former it was modified with different loadings of La2O3 prepared by co-precipitation method.The catalysts were characterized by BET,XRD,N2O-adsorption,EXAFS,H2-TPR,NH3-TPD techniques and evaluated in the synthesis of dimethyl ether from syngas.The results show that La2O3 promoted catalysts displayed a significantly better catalytic performance compared with Cu-ZrO2/γ-Al2O3 catalyst in CO conversion and DME selectivity,and the optimum catalytic activity was obtained when the content of La2O3 was 12 wt%.The characterizations reveal that high copper dispersion,facile reducibility of copper particles and appropriate amount of acidic sites are responsible for the superior catalytic performance.

  6. Highly efficient synthesis of dimethyl ether from syngas over the admixed catalyst of CuO-ZnO-Al{sub 2}O{sub 3} and antimony oxide modified HZSM-5 zeolite

    Energy Technology Data Exchange (ETDEWEB)

    Dongsen Mao; Guanzhong Lu [Research Institute of Applied Catalysis, Department of Chemical Engineering, Shanghai Institute of Technology, Shanghai 200235 (China); Jianchao Xia; Bin Zhang [Shanghai Research Institute of Petrochemical Technology, SINOPEC, Shanghai 201208 (China)

    2010-06-15

    A series of HZSM-5 zeolites modified with various contents of antimony oxide (0-30 wt.%) were prepared by solid state ion reaction at 500 C, and the acidities of the resulted materials were characterized by temperature-programmed desorption of NH{sub 3}. The direct synthesis of dimethyl ether (DME) from syngas was carried out over the admixed catalysts of an industrial CuO-ZnO-Al{sub 2}O{sub 3} methanol synthesis catalyst and the parent and antimony oxide modified HZSM-5 zeolites under pressurized fixed-bed continuous flow conditions. The results indicated that modification of HZSM-5 with suitable amount of antimony oxide significantly decreased the selectivity for undesired byproducts like hydrocarbons and carbon dioxide from 9.3% and 32.4% to less than 1% and 28%, respectively, so the selectivity for DME was enhanced greatly from 55% to 69% under temperature of 260 C, pressure of 4 MPa and gas hourly space velocity of 1500 mL h{sup -1} g{sub cat}{sup -1}. The decrease in the formation of hydrocarbons and carbon dioxide can be attributed to the significant decline in the amount of strong acid sites of the HZSM-5 zeolite induced by antimony oxide modification. Additionally, the influences of the operating parameters on the performance of the most efficient catalyst were also investigated. The results showed that high reaction temperature and high gas hourly space velocity resulted in both lower carbon monoxide conversion and lower dimethyl ether selectivity, so they should be no higher than 280 C and 3000 mL h{sup -1} g{sub cat}{sup -1}, respectively. (author)

  7. Highly efficient synthesis of dimethyl ether from syngas over the admixed catalyst of CuO-ZnO-Al{sub 2}O{sub 3} and antimony oxide modified HZSM-5 zeolite

    Energy Technology Data Exchange (ETDEWEB)

    Mao Dongsen, E-mail: dsmao1106@yahoo.com.c [Research Institute of Applied Catalysis, Department of Chemical Engineering, Shanghai Institute of Technology, Shanghai 200235 (China); Xia Jianchao; Zhang Bin [Shanghai Research Institute of Petrochemical Technology, SINOPEC, Shanghai 201208 (China); Lu Guanzhong [Research Institute of Applied Catalysis, Department of Chemical Engineering, Shanghai Institute of Technology, Shanghai 200235 (China)

    2010-06-15

    A series of HZSM-5 zeolites modified with various contents of antimony oxide (0-30 wt.%) were prepared by solid state ion reaction at 500 deg. C, and the acidities of the resulted materials were characterized by temperature-programmed desorption of NH{sub 3}. The direct synthesis of dimethyl ether (DME) from syngas was carried out over the admixed catalysts of an industrial CuO-ZnO-Al{sub 2}O{sub 3} methanol synthesis catalyst and the parent and antimony oxide modified HZSM-5 zeolites under pressurized fixed-bed continuous flow conditions. The results indicated that modification of HZSM-5 with suitable amount of antimony oxide significantly decreased the selectivity for undesired byproducts like hydrocarbons and carbon dioxide from 9.3% and 32.4% to less than 1% and 28%, respectively, so the selectivity for DME was enhanced greatly from 55% to 69% under temperature of 260 deg. C, pressure of 4 MPa and gas hourly space velocity of 1500 mL h{sup -1} g{sub cat}{sup -1}. The decrease in the formation of hydrocarbons and carbon dioxide can be attributed to the significant decline in the amount of strong acid sites of the HZSM-5 zeolite induced by antimony oxide modification. Additionally, the influences of the operating parameters on the performance of the most efficient catalyst were also investigated. The results showed that high reaction temperature and high gas hourly space velocity resulted in both lower carbon monoxide conversion and lower dimethyl ether selectivity, so they should be no higher than 280 deg. C and 3000 mL h{sup -1} g{sub cat}{sup -1}, respectively.

  8. On the predictive capabilities of CPA for applications in the chemical industry: Mulficomponent mixtures containing methyl-methacrylate, dimethyl-ether or acetic acid

    DEFF Research Database (Denmark)

    Tsivintzelis, Ioannis; Kontogeorgis, Georgios

    2014-01-01

    with acetic acid, esters, ethers and alcohols, and in this case for water-acetic acid the CPA-Huron Vidal (CPA-HV) version of the model is used. For the latter binary mixture, new CPA-HV binary parameter sets are estimated using, among others, data for activity coefficients at infinite dilutions. The modeling...... for the acetic acid-water system for which different parameter sets at different temperatures can be recommended. Even with the use of CPA-HV mixing rules, modeling of the acetic acid-water system with few interaction parameters remains a challenging task. Excellent simultaneous VLE and LLE correlation...... is obtained for complex systems such as aqueous mixtures with ethers and esters. The multicomponent results are, with a few exceptions, very satisfactory, especially for the vapor-liquid equilibrium cases. For the demanding aqueous acetic acid-water containing systems, one parameter set is recommended...

  9. 生物质炭和富二氧化碳合成气制取二甲醚%Dimethyl Ether Production from Biomass Char and CO2-Rich Bio-Syngas

    Institute of Scientific and Technical Information of China (English)

    徐勇; 颜世志; 叶同奇; 张钊; 李全新

    2011-01-01

    We report on a novel approach toward dimethyl ether (DME) synthesis using crude CO2-rich bio-syngas and biomass char.The crude bio-syngas was derived from bio-oil reforming and was initially conditioned by catalytic conversion into CO-rich bio-syngas using biomass char over the Ni/Al203 catalyst.The molar ratio of CO2 to CO significantly decreased from 6.33 in the CO2-rich bio-syngas to 0.21 after bio-syngas conditioning at 800 C.The yield of dimethyl ether from the conditioned bio-syngas was about four times higher than that from the CO2-rich bio-syngas over the Cu-ZnO-Al2O3/HZSM-5 catalyst.This work potentially provides a useful approach toward producing biofuels and chemicals from bio-syngas and a novel utilization of biomass char.%研究了一种利用富二氧化碳合成气和生物质炭联合制取二甲醚的方法,其过程包括两个步骤:富二氧化碳合成气调整以及调整后合成气合成二甲醚.在合成气调整过程中,利用生物质炭为原料在Ni/Al2O3催化剂上将富二氧化碳合成气调整为富一氧化碳合成气.经过800℃合成气调整后,合成气中CO2含量大幅降低而CO含量大幅提高,CO2/CO的摩尔比从原始合成气的6.33降至0.21.然后,分别用调整前后的合成气合成二甲醚,结果表明,经过调整后,C转化率得到很大的提高,二甲醚产率比调整前高4倍.本工作提供了一种可利用富二氧化碳生物质合成气制取燃料的途径,并且提供了一种新的利用生物质炭的方法.

  10. Cu-Zn-Al-Zr浆状催化剂二甲醚合成宏观动力学%Global kinetics of direct synthesis of dimethyl ether from syngas in slurry reactor over Cu-Zn-Al-Zr catalyst

    Institute of Scientific and Technical Information of China (English)

    陈振; 张海涛; 应卫勇; 房鼎业

    2011-01-01

    在压力3MPa~7MPa,温度220℃~260℃,空速0.4 L·g-1·h-1~1.2 L·g1·h-1,气体摩尔分率yH2 0.75~0.65,y∞ 0.14~0.20,y(00)2 0.04~0.08,搅拌转速1000 r·min-1的反应条件下,于500mL高压搅拌釜中进行了合成气在Cu-Zn-Al-Zr浆状催化剂上一步法合成二甲醚工艺过程的宏观动力学研究.基于CO加氢合成甲醇、CO2加氢合成甲醇及甲醇脱水为二甲醚三个独立反应,建立了Langmuir-Hinshelwood型宏观动力学模型.采用通用遗传算法和Levenberg-Marquardt优化算法相结合的方法对实验数据进行拟合、参数寻优,获得模型参数估值,经统计检验和残差分析证实了模型的可靠性.%The global kinetics of the slurry synthesis of dimethyl ether from syngas in a stirred autoclave over Cu-Zn-Al-Zr catalyst was studied at pressure of 3-7MPa, temperature of 220-260'C, WHSV of 0.4-1.2 L-g'-h"1 and mole fractions of H2, CO and CO2 in feed gas of 0.75-0.65, 0.14-0.20 and 0.04-0.08, respectively. Three reactions, CO hydrogenation to methanol, C02 hydrogenation to methanol and methanol dehydration to dimethyl ether, were chosen as the independent reactions and based on that a Langmuir-Hinshelwood type global kinetic model was built. The model parameters were estimated by fitting experimental data and parameter optimization based on general Genetic Algorithm and Levenberg- Marquardt methods, and the reliability of model was verified by statistical test and residual error analysis.

  11. Synthesis of dimethyl ether and alternative fuels in the liquid phase from coal-derived synthesis gas. Task 3.2: Screen novel catalyst systems; Task 3.3:, Evaluation of the preferred catalyst system

    Energy Technology Data Exchange (ETDEWEB)

    Underwood, R.P.

    1993-01-01

    As part of the DOE-sponsored contract ``Synthesis of Dimethyl Ether and Alternative Fuels in the Liquid Phase from Coal-Derived Syngas`` experimental evaluations of the one-step synthesis of alternative fuels were carried out. The objective of this work was to develop novel processes for converting coal-derived syngas to fuels or fuel additives. Building on a technology base acquired during the development of the Liquid Phase Methanol (LPMEOH) process, this work focused on the development of slurry reactor based processes. The experimental investigations, which involved bench-scale reactor studies, focused primarily on three areas: (1) One-step, slurry-phase syngas conversion to hydrocarbons or methanol/hydrocarbon mixtures using a mixture of methanol synthesis catalyst and methanol conversion catalyst in the same slurry reactor. (2) Slurry-phase conversion of syngas to mixed alcohols using various catalysts. (3) One-step, slurry-phase syngas conversion to mixed ethers using a mixture of mixed alcohols synthesis catalyst and dehydration catalyst in the same slurry reactor. The experimental results indicate that, of the three types of processes investigated, slurry phase conversion of syngas to mixed alcohols shows the most promise for further process development. Evaluations of various mixed alcohols catalysts show that a cesium-promoted Cu/ZnO/Al{sub 2}O{sub 3} methanol synthesis catalyst, developed in Air Products` laboratories, has the highest performance in terms of rate and selectivity for C{sub 2+}-alcohols. In fact, once-through conversion at industrially practical reaction conditions yielded a mixed alcohols product potentially suitable for direct gasoline blending. Moreover, an additional attractive aspect of this catalyst is its high selectivity for branched alcohols, potential precursors to iso-olefins for use in etherification.

  12. Ionic photofragmentation and photoionization of dimethyl ether in the VUV and soft X-ray regions (8.5 80 eV) absolute oscillator strengths for molecular and dissociative photoionization

    Science.gov (United States)

    Feng, Renfei; Cooper, Glyn; Brion, C. E.

    2001-08-01

    The branching ratios for molecular and dissociative photoionization of dimethyl ether (CH 3OCH 3, DME) have been measured in the VUV and soft X-ray regions using dipole (e,e+ion) coincidence spectroscopy (˜1 eV FWHM) at equivalent photon energies from the first ionization threshold up to 80 eV. The absolute partial oscillator strengths (cross-sections) for molecular and dissociative photoionization have been determined from recently published absolute photoabsorption oscillator strength data [R. Feng, G. Cooper, C.E. Brion, Chem. Phys. 260 (2000) 391] together with the photoionization branching ratios and the (multi-dissociative-corrected) photoionization efficiency obtained from time-of-flight mass spectra reported in the present work. No stable multiply charged molecular ion(s) from DME have been found in the present work. However, the fact that the photoionization efficiency has been measured as greater than unity above ˜30 eV indicates the existence of multi-dissociative products from Coulomb explosion of multiply charged ions. Appearance potentials of all ion products from DME are also reported. The presently reported results are compared with the previously published data where possible.

  13. System-size corrections for self-diffusion coefficients calculated from molecular dynamics simulations: The case of CO2, n-alkanes, and poly(ethylene glycol) dimethyl ethers

    Science.gov (United States)

    Moultos, Othonas A.; Zhang, Yong; Tsimpanogiannis, Ioannis N.; Economou, Ioannis G.; Maginn, Edward J.

    2016-08-01

    Molecular dynamics simulations were carried out to study the self-diffusion coefficients of CO2, methane, propane, n-hexane, n-hexadecane, and various poly(ethylene glycol) dimethyl ethers (glymes in short, CH3O-(CH2CH2O)n-CH3 with n = 1, 2, 3, and 4, labeled as G1, G2, G3, and G4, respectively) at different conditions. Various system sizes were examined. The widely used Yeh and Hummer [J. Phys. Chem. B 108, 15873 (2004)] correction for the prediction of diffusion coefficient at the thermodynamic limit was applied and shown to be accurate in all cases compared to extrapolated values at infinite system size. The magnitude of correction, in all cases examined, is significant, with the smallest systems examined giving for some cases a self-diffusion coefficient approximately 15% lower than the infinite system-size extrapolated value. The results suggest that finite size corrections to computed self-diffusivities must be used in order to obtain accurate results.

  14. Stability of a Bifunctional Cu-Based Core@Zeolite Shell Catalyst for Dimethyl Ether Synthesis Under Redox Conditions Studied by Environmental Transmission Electron Microscopy and In Situ X-Ray Ptychography.

    Science.gov (United States)

    Baier, Sina; Damsgaard, Christian D; Klumpp, Michael; Reinhardt, Juliane; Sheppard, Thomas; Balogh, Zoltan; Kasama, Takeshi; Benzi, Federico; Wagner, Jakob B; Schwieger, Wilhelm; Schroer, Christian G; Grunwaldt, Jan-Dierk

    2017-06-01

    When using bifunctional core@shell catalysts, the stability of both the shell and core-shell interface is crucial for catalytic applications. In the present study, we elucidate the stability of a CuO/ZnO/Al2O3@ZSM-5 core@shell material, used for one-stage synthesis of dimethyl ether from synthesis gas. The catalyst stability was studied in a hierarchical manner by complementary environmental transmission electron microscopy (ETEM), scanning electron microscopy (SEM) and in situ hard X-ray ptychography with a specially designed in situ cell. Both reductive activation and reoxidation were applied. The core-shell interface was found to be stable during reducing and oxidizing treatment at 250°C as observed by ETEM and in situ X-ray ptychography, although strong changes occurred in the core on a 10 nm scale due to the reduction of copper oxide to metallic copper particles. At 350°C, in situ X-ray ptychography indicated the occurrence of structural changes also on the µm scale, i.e. the core material and parts of the shell undergo restructuring. Nevertheless, the crucial core-shell interface required for full bifunctionality appeared to remain stable. This study demonstrates the potential of these correlative in situ microscopy techniques for hierarchically designed catalysts.

  15. Stability of a Bifunctional Cu-Based Core@Zeolite Shell Catalyst for Dimethyl Ether Synthesis Under Redox Conditions Studied by Environmental Transmission Electron Microscopy and In Situ X-Ray Ptychography

    DEFF Research Database (Denmark)

    Baier, Sina; Damsgaard, Christian Danvad; Klumpp, Michael

    2017-01-01

    When using bifunctional core@shell catalysts, the stability of both the shell and core-shell interface is crucial for catalytic applications. In the present study, we elucidate the stability of a CuO/ZnO/Al2O3@ZSM-5 core@shell material, used for one-stage synthesis of dimethyl ether from synthesis...... gas. The catalyst stability was studied in a hierarchical manner by complementary environmental transmission electron microscopy (ETEM), scanning electron microscopy (SEM) and in situ hard X-ray ptychography with a specially designed in situ cell. Both reductive activation and reoxidation were applied....... The core-shell interface was found to be stable during reducing and oxidizing treatment at 250°C as observed by ETEM and in situ X-ray ptychography, although strong changes occurred in the core on a 10 nm scale due to the reduction of copper oxide to metallic copper particles. At 350°C, in situ X...

  16. Preparation and catalytic performance of CuO-znO-AlO3/clinoptilolite nanocatalyst for single-step synthesis of dimethyl ether from syngas as a green fuel.

    Science.gov (United States)

    Khoshbin, Reza; Haghighi, Mohammad

    2013-07-01

    Direct conversion of syngas to dimethyl ether was successfully carried out over a clinoptilolite supported nanocatalyst modified by NH4Cl. A series of bifunctional nanocatalysts, CuO-ZnO-Al2O3 (CZA) over Clinoptilolite with different loading of CZA, were prepared via coprecipitation method and their catalytic performance were compared in a fixed-bed high pressure reactor. The catalysts were characterized by XRD, BET, FESEM, FTIR and TPD-NH3 techniques. The physicochemical analysis showed that with NH4CI treatment, the specific surface area of clinoptilolite increased obviously, while its crystallinity decreased slightly. It was found that the crystallinity of clinoptilolite was dramatically changed, whereas crystallinity of CuO has not been influenced significantly by the increase of CZA content. Moreover, with increasing the CZA/Clinoptilolite ratio, the specific surface area of nanocatalysts decreased. It is shown that the CZA particle size is distributed between 30.5-131.2 nm with an average size of 70.6 nm in which 77.8% of the particles are in the range of below 100 nm. The TPD-NH3 patterns showed that the number of the acid sites of the nanocatalysts decreased with the increase the CZA content. The influence of reaction pressure was investigated, confirming that the optimal reaction pressure for this catalyst was 40 bar. The catalytic performance is shown that the CZA/Clinoptilolite = 2 nanocatalyst had higher activity, selectivity due to its higher acidic sites.

  17. CALCinATION OF EQUILIBRIUM FOR DIMETHYL ETHER SYNTHESIS FROM BIOMASS-SYNGAS%生物质气一步法合成二甲醚化学平衡分析

    Institute of Scientific and Technical Information of China (English)

    许庆利; 蓝平; 隋淼; 颜涌捷

    2011-01-01

    Thermodynamic calculation was carried out for the compound reaction system of dimethyl ether (DME) from biomass-syngas. Methanol synthesis from CO, CO2, and dehydration of metlanol to DME were selected as the independent reactions, CO, CO2 and DME were chosen as the key components. At the same time, the calculated model about DME synthesis was put forward. The article discussed the effect of temperature and pressure on the chemical balance of biomass synthesis of DME. The results showed that the equilibrium conversion of CO and the equilibrium yield of DME decrease with the increase of temper, and increase with the increase of pressure.%对生物质基合成气合成二甲醚反应体系进行热力学参数计算.选取CO、CO2加氢合成甲醇及甲醇脱水生成二甲醚为独立反应,CO、CO2、二甲醚为关键组分,提出了合成气合成二甲醚的计算模型.讨论了温度、压力对生物质气合成二甲醚化学平衡的影响.结果表明:CO平衡转化率、DME平衡收率随温度的升高而下降;随压力升高,CO平衡转化率、DME平衡收率增加.

  18. CO2加H2在三相床中一步法制二甲醚%One-step Synthesis of Dimethyl Ether from CO2+H2 in a Three-phase Reactor

    Institute of Scientific and Technical Information of China (English)

    柯思明; 刘殿华; 曹发海; 房鼎业

    2001-01-01

    One step synthesis of dimethyl ether from carbon dioxide and hydrogen over hybrid catalyst composed of C302 catalyst for methanol synthesis and CM-3-1 catalyst for methanol dehydration in a mechanical agitated autoclave has been studied. Effect of reaction conditions including temperature and pressure on the conversion rate and product selectivity was observed. Because of the presence of the inert liquid phase in this process, syngas conversion can be significantly improved by co-product of DME along with methanol. The coproduct strategy improves the thermodynamics and kinetic environment of the reaction system.%采用甲醇合成C302催化剂与甲醇脱水CM-3-1催化剂组成的复合催化剂,在高压机械搅拌反应釜中进行了CO2加H2一步法合成二甲醚的研究,使用CO2∶H2=1∶3(V∶V)的原料气考察了温度、压力对反应转化率与各产物选择性的影响。

  19. A Mixing Based Model for DME Combustion in Diesel Engines

    DEFF Research Database (Denmark)

    Bek, Bjarne H.; Sorenson, Spencer C.

    1998-01-01

    A series of studies has been conducted investigating the behavior of di-methyl ether (DME) fuel jets injected into quiescent combus-tion chambers. These studies have shown that it is possible to make a good estimate of the penetration of the jet based on existing correlations for diesel fuel...

  20. A mixing based model for DME combustion in diesel engines

    DEFF Research Database (Denmark)

    Bek, Bjarne Hjort; Sorenson, Spencer C

    2001-01-01

    A series of studies has been conducted investigating the behavior of di-methyl ether (DME) fuel jets injected into quiescent combustion chambers. These studies have shown that it is possible to make a good estimate of the penetration of the jet based on existing correlations for diesel fuel...

  1. 一种新型的二甲醚精馏节能工艺优化及应用%Optimization and application of a novel energy-saving dimethyl ether distillation process

    Institute of Scientific and Technical Information of China (English)

    闫常群; 隋然; 华超; 白芳

    2013-01-01

    In order to decrease energy consumption of dimethyl ether (DME) production, a novel distillation process with two-phase multi-streams feed and new high efficient column internals was proposed. By modeling and optimization of the novel process with the software PROII, the effects of operation parameters, such as feed temperature, feed flow ratio of two phases and reflux ratio, on energy consumption of the distillation process were analyzed and the optimum operation conditions were determined. The optimized DME distillation process had been used to modify a distillation system of a 50,000 ton a year DME plant, and in a six month running period the system was steady and the steam consumption of the DME production process could be reduced to below 1.0 tons per ton DME, achieving remarkable energy-saving.%为了降低二甲醚生产能耗,提出了精馏塔采用汽液两相多股进料和采用新型高效塔内件的二甲醚精馏新工艺,并用PROII软件对其进行了模拟和优化,详细分析了进料温度、进料气液流量配比、回流比等操作参数对分离过程能耗的影响。按照优化后的二甲醚精馏工艺方案对某企业的15万t/a二甲醚精馏装置进行改造,经工业实际运行6个月可知,装置运行正常且生产吨二甲醚消耗蒸汽达到1.0 t以下,节能效果显著。

  2. Process Design and Economics for the Conversion of Lignocellulosic Biomass to Hydrocarbons via Indirect Liquefaction. Thermochemical Research Pathway to High-Octane Gasoline Blendstock Through Methanol/Dimethyl Ether Intermediates

    Energy Technology Data Exchange (ETDEWEB)

    Tan, E. C. D.; Talmadge, M.; Dutta, A.; Hensley, J.; Schaidle, J.; Biddy, M.; Humbird, D.; Snowden-Swan, L. J.; Ross, J.; Sexton, D.; Yap, R.; Lukas, J.

    2015-03-01

    This report was developed as part of the U.S. Department of Energy’s Bioenergy Technologies Office’s (BETO’s) efforts to enable the development of technologies for the production of infrastructure-compatible, cost-competitive liquid hydrocarbon fuels from lignocellulosic biomass feedstocks. The research funded by BETO is designed to advance the state of technology of biomass feedstock supply and logistics, conversion, and overall system sustainability. It is expected that these research improvements will be made within the 2022 timeframe. As part of their involvement in this research and development effort, the National Renewable Energy Laboratory and the Pacific Northwest National Laboratory investigate the economics of conversion pathways through the development of conceptual biorefinery process models and techno-economic analysis models. This report describes in detail one potential conversion process for the production of high-octane gasoline blendstock via indirect liquefaction of biomass. The processing steps of this pathway include the conversion of biomass to synthesis gas or syngas via indirect gasification, gas cleanup, catalytic conversion of syngas to methanol intermediate, methanol dehydration to dimethyl ether (DME), and catalytic conversion of DME to high-octane, gasoline-range hydrocarbon blendstock product. The conversion process configuration leverages technologies previously advanced by research funded by BETO and demonstrated in 2012 with the production of mixed alcohols from biomass. Biomass-derived syngas cleanup via reforming of tars and other hydrocarbons is one of the key technology advancements realized as part of this prior research and 2012 demonstrations. The process described in this report evaluates a new technology area for the downstream utilization of clean biomass-derived syngas for the production of high-octane hydrocarbon products through methanol and DME intermediates. In this process, methanol undergoes dehydration to

  3. Development of Lubricity Evaluation Bench for Low-boiling Point Dimethyl Ether Fuel%低沸点燃料二甲醚润滑性评估实验台的研制

    Institute of Scientific and Technical Information of China (English)

    宋磊; 陈晓玲; 张武高; 浦耿强

    2012-01-01

    二甲醚在常温常压下为气态,不能用传统方法评估其润滑性能.根据低沸点燃油的物理特性和高频往复机(HFRR)的基本原理,设计可加压的高频往复机,初步搭建用于低沸点燃油的摩擦磨损试验台架,并采用常规燃油进行油品的可分辨性试验.结果表明,该台架可以用于评价不同油品的润滑性,为二甲醚等低沸点燃油润滑性能评估方法的建立奠定了基础.%Because dimethyl ether (DME) is gaseous at normal temperature and pressure, it is impossible to evaluate the lubricity of DME by using traditional methods. According to the principle of High Frequency Reciprocating Rig (HFRR)and the physical properties of low-boiling point fuel,a HFRR with pressure control was designed, and a wear test device for low-boiling point fuel was constructed. A preliminary resolution test with some regular fuels was done. The results show that the lubricity of different fuels can be evaluated by this rig, and it lays a solid foundation for the establishment of lubricity evaluation method about low-boiling point fuel like DME.

  4. Di-μ-acetato-bis-(dimethyl-formamide)-penta-kis-(μ-N,2-dioxidobenzene-1-car-boximidato)tetra-kis-(1-ethyl-imidazole)-penta-manganese(III)-manganese(II)-diethyl ether-dimethyl-foramide-methanol-water (1/1/1/1/0.12).

    Science.gov (United States)

    Tigyer, Benjamin R; Zeller, Matthias; Zaleski, Curtis M

    2011-08-01

    The title compound [Mn(6)(C(7)H(4)NO(3))(5)(CH(3)CO(2))(2)(C(5)H(8)N(2))(4)(C(3)H(7)NO)(2)]·(C(2)H(5))(2)O·C(3)H(7)NO·CH(3)OH·0.12H(2)O, abbreviated as Mn(II)(OAc)(2)[15-MC(MnIII(N)shi)-5](EtIm)4(DMF)2·diethyl ether·DMF·MeOH·0.12H(2)O (where (-)OAc is acetate, MC is metallacrown, shi(3-) is salicylhydroximate, EtIM is n-ethylimidazole, DMF is N,N-dimethylformamide, and MeOH is methanol) contains five Mn(III) ions as members of the metallacrown ring and an Mn(II) ion bound in the central cavity. The central Mn(II) ion is seven-coordinate with a distorted face-capped trigonal-prismatic geometry. The five Mn(III) ions of the metallacrown ring are six-coordinate with distorted octa-hedral geometries. The configuration of the Mn(III) ions about the metallacrown ring follow a ΔΛΔPP pattern, with P representing planar. The four 1-ethyl-imidazole ligands are bound to four different Mn(III) ions. A diethyl ether solvent mol-ecule was found to be disordered over two mutually exclusive sites with an occupancy ratio of 0.568 (7):0.432 (7). A methanol solvent mol-ecule was found to be disordered over two mutually exclusive sites by being hydrogen bonded either to a dimethyl-formamide solvent mol-ecule (major occupancy component) or to an O atom of the main mol-ecule (minor occupancy component). The occupancy ratio refined to 0.678 (11):0.322 (11). Associated with the minor component is a partially occupied water mol-ecule [total occupancy 0.124 (15)].

  5. Hydrogen production from partial oxidation of dimethyl ether by spark discharge plasma%基于火花放电等离子体部分氧化重整二甲醚制氢研究

    Institute of Scientific and Technical Information of China (English)

    马奎峰; 李兴虎

    2011-01-01

    Experiments involving hydrogen production from dimethyl ether (DME) were performed with a multistage plasma converter at atmospheric pressure. The results of these experiments show that the DME conversion and H2 yield initially increase and then decrease with the pulse duty ratio increasing. The maximal values of the DME conversion and H2 yield are 87.6% and 39.4% at a pulse duty ratio of 80%, respectively. As the increase in voltage of the electric source, the conversion and H2 yield increase significantly, since both the spark energy and the resident time of a spark in chamber are enhanced. When the heat preservation configuration or humidifying reactant is employed, the DME conversion rate and the H2 yield are enhanced, while the energy consumption is much lower than standard situation at each discharge frequency and the thermal efficiency is enhanced. Owing to insufficient oxygen, the carbon deposit is formed on the electrodes. With the increase in the A/D ratio, the carbon deposit on both the electrodes is clearly reduced.%应用自制的多级式等离子体富氢气体制备装置,进行了二甲醚部分氧化重整制氢实验.实验结果表明,常温常压下二甲醚的转化率和氢产率随占空比的增大先增大后减小,当占空比为80%时最大值分别为87.6%和39.4%.随着电源电压的增加,放电能量和持续时间逐渐增加,转化率和氢产率逐渐增加.当反应器采用保温措施或对反应物进行加湿时,转化率和氢产率均有明显提高,同时制氢能耗下降,热效率有一定提高.实验过程中附着在电极上的积炭主要是由于氧气不足造成,随空醚比的增大,积炭明显减少.

  6. CuZnAl双功能催化剂上一步法合成二甲醚的工艺研究%Study on Single-step Synthesis of Dimethyl Ether over CuZnAl Bifunctional Catalyst

    Institute of Scientific and Technical Information of China (English)

    吴文炳; 倪建聪; 林顺华; 林志文; 宋建龙; 杨顺童

    2011-01-01

    探讨TC301/γ-Al2O3和C207/γ-Al2O3双功能催化剂上合成气一步法制取二甲醚的反应,考察了催化剂浓度、原料气氢碳比和搅拌转速对一氧化碳转化率和二甲醚收率的影响.结果表明:在浆态床反应器内,催化剂C301的催化效果优于C207,且催化剂最佳浓度为7.27%;在300r/min搅拌转速下,外扩散阻力的影响基本可以消除;当原料气氢碳比为1.0时,二甲醚收率最大,进而提出利用富碳合成气生产二甲醚是缓解能源问题和减少能源污染的一条新途径.%The direct conversion of syngas into dimethyl ether over CuZnAI bifunctional catalyst was studied. Effect of catalyst concentration, feed gas ratio and stirring speed on CO conversion and DME yield was investigated. The results showed that C301 catalyst exhibited better performance than C207 catalyst in a slurry reactor, and the optimum concentration of catalyst was 7.27%. The resistance of external diffusion was eliminated when stirring speed reaching 300 r/min. When feed gas ratio between hydrogen and carbon was 1:1, the DME yield reached the maximum, and the production of DME from rich CO syngas was put forward, which is a new approach of solving energy problems and reducing environmental pollution from fuel combustion.

  7. 掺杂H2和CO2对二甲醚燃烧的耦合化学作用研究%Coupled Chemical Effects of Carbon Dioxide and Hydrogen Additions on Dimethyl Ether Flames

    Institute of Scientific and Technical Information of China (English)

    潘伟; 刘冬

    2016-01-01

    对掺杂H2和CO2的二甲醚预混火焰进行研究,分析H2和CO2的化学效应对二甲醚燃烧火焰温度、主要产物、中间产物和自由基的耦合影响。结果表明,在10%H2条件下,CO2浓度越高,其化学效应对温度下降,二甲醚消耗,乙炔、甲醛、乙醛及H生成的抑制作用越强,对O、OH 生成的促进作用也越强;H2的化学效应对温度升高和二甲醚燃烧的促进作用随CO2浓度升高而增强,对H生成的促进作用随CO2浓度升高而减弱,对O、OH、乙炔、甲醛及乙醛生成的促进作用与CO2浓度无关。%Kinetic analysis about coupled chemical effects of CO2 and H2 additions on laminar premixed dimethyl ether flames is performed. The coupled chemical effects of CO2 and H2 addition are analyzed on aspects of temperature, major species, intermediate stable species and radicals. The result shows that when H2 is added, the CO2 chemical effects, which can decrease the temperature, the DME oxidation, the production of C2H2, CH2O, CH3CHO and H radical but promote the production of O and OH radicals, would varies directly with the CO2 concentration. However, CO2 addition can strengthen the H2 chemical effects on increasing the temperature and DME consumption, but mitigate the H2 chemical effects on reducing the H mole fraction. And the CO2 concentration did not have obvious influence on the H2 chemical effects on increasing the production of O, OH, C2H2, CH2O and CH3CHO.

  8. 二甲醚催化转化制甲苯的反应研究%Catalytic conversion of dimethyl ether to toluene over the molecular sieves modified with tungsten oxide

    Institute of Scientific and Technical Information of China (English)

    王博; 王辉; 刘广波; 李琢; 李学民; 吴晋沪

    2014-01-01

    在氧气气氛中,对氧化钨改性的不同分子筛催化剂上二甲醚( DME)转化反应进行了评价。结果表明,WO3/HZSM-5催化剂上DME可以高选择性转化为甲苯,对其反应工艺条件进行了优化,常压、290℃、DME/O2比为2:1时,二甲醚几乎完全转化,转化率为98.97%,甲苯的选择性达到39.71%。对催化剂结构和酸性进行表征,结果表明,ZSM-5分子筛的孔道结构最有利于甲苯的生成,WO3的介入调整了HZSM-5分子筛表面的酸性活性位点分布,在氧气气氛中有效地抑制了副产物的生成,使产物中甲苯的选择性提高。%The catalytic performance of various zeolites modified with tungsten oxide in the conversion of dimethyl ether ( DME ) to toluene in the presence of oxygen was investigated in a continuous flow fixed-bed reactor. The results indicated that WO3/HZSM-5 as a catalyst is highly selective in the conversion of DME to toluene;under the optimized conditions, i. e. atmospheric pressure, 290℃, and with a DME/O2 mol ratio of 2:1, the conversion of DME is 98. 97%, with the selectivity of 39. 71% to toluene. The characterization results about the catalyst structure and acidity illustrate that the porous structure of ZSM-5 is suitable for the formation of toluene from DME. The doping of WO3 adjusts the distribution of the surface acid sites and then inhibits the formation of side-products in the presence of oxygen, which is able to enhance the selectivity to toluene.

  9. Numerical modeling and simulation on dimethyl ether synthesis in a bubble column slurry reactor%浆态床法合成二甲醚的模拟研究

    Institute of Scientific and Technical Information of China (English)

    洪若瑜; 庄银枪; 杨伟

    2004-01-01

    对于直接以合成气作为原料,使用Cu-Zn-Al和γ-Al2O3构成的双重催化剂、采用浆态床法合成二甲醚的反应体系,使用全混流反应器模型结合化学反应动力学进行模拟.组分方程使用超松弛迭代方法并结合C++编程进行求解,编制了计算机程序.通过模拟计算,讨论了压力、温度、空速、催化剂配比、反应气中不同氢碳比以及CO2含量对反应收率、DME选择性的影响,并讨论了在不同氢碳比下对CO转化率和CO与H2总转化率的影响,从而寻找合适的反应条件,为工业化生产提供参考.%A complete-mixing-flow-reactor model together with detailed chemical reaction kinetics was used to simulate the synthesis of dimethyl ether (DME) in a bubble column slurry reactor using syngas directly. The derived non-linear equations were solved using under-relaxation iteration method. The programming language C + + was employed to implement the numerical algorithm. The influences of pressure, temperature and superficial gas velocity in the reactor, catalyst ratio, CO/H2 ratio and CO2 content of the feed gas on the conversion, yield and DME selectivity were studied. The influences of different CO/H2 ratio on CO conversion and total conversion were also studied. The optimal reaction conditions were found, which can be used as a worthwhile reference for engineering scale-up and design.

  10. Perfluorosulfonic acid resin catalyst for dimethyl ether synthesis by methanol dehydration%甲醇制二甲醚用全氟磺酸树脂催化剂的研究

    Institute of Scientific and Technical Information of China (English)

    史立杰; 李晨佳; 常俊石

    2014-01-01

    A new catalyst perfluorosulfonate resin/SiO2 for vapor phase dehydration of methanol(Me) to dimethyl ether(DME) was prepared by sol-gel method. The as-prepared catalyst was characterized by X-ray diffraction,Fourier transform infrared spectroscopy,thermogravimetry-dirfferential scanning calorimetry , low-temperature nitrogen adsorption method and NH3 temperature-programmed desorption. The effects of reaction conditions such as temperature,liquid hourly space velocity (LHSV) and active component content on the reaction performance and catalyst stability were investigated. The results indicated that the BET specific surface area of microporous catalyst was 820m2/g. After a continuous run under conditions:w(PFSA)=10.0%,LHSV(Me)=1h-1,t=184℃,it is found that the activity and stability of the catalyst kept steady with the Me conversion,DME selectivity being>91.5%,>99.9%respectively.%采用溶胶-凝胶法制备了用于甲醇气相脱水制二甲醚的新型催化剂全氟磺酸树脂/二氧化硅,应用X射线衍射、红外光谱、热重-差示扫描量热、低温氮物理吸附和氨程序升温脱附法对所得催化剂进行了表征。考察了反应温度、甲醇液空速、全氟磺酸树脂含量对甲醇气相催化脱水制二甲醚反应性能和催化剂稳定性的影响。结果表明,催化剂比表面积达820m2/g,在全氟磺酸树脂负载量10.0%、甲醇液空速1h-1、反应温度184℃时,甲醇转化率92.0%,二甲醚选择性99.9%,经350h实验测试,活性和稳定性没有明显变化。

  11. Steam Reforming of Dimethyl Ether over Coupled ZSM-5 and Cu-Zn-Based Catalysts%二甲醚水蒸气重整制氢的ZSM-5和Cu-Zn的复合催化体系

    Institute of Scientific and Technical Information of China (English)

    冯冬梅; 左宜赞; 王德峥; 王金福

    2009-01-01

    Dimethyl ether (DME) steam reforming (SR) is one possible source of hydrogen for fuel cells. The synergistic effect of catalyst coupling for the DME SR process and the coupling of reaction-heat transfer was studied. A DME hydrolysis catalyst comprising ZSM-5 (Si/A; = 25) and a series of methanol steam reforming catalysts (a series of Cu-Zn-based catalysts and a commercial Cu-Zn-Al catalyst) were used for DME SR. The evaluation of catalytic activity was conducted in a fixed-bed reactor. The catalysts were characterized by scanning electron microscopy, X-ray diffraction, and N2 adsorption. The activity and selectivity were influenced by the catalyst composition and copper content, and also the content of Al and Zr. A Cu:Zn molar ratio of 60:30 together with Al and Zr gave the best dispersion of Cu crystals and the highest low-temperature catalytic activity, with a DME conversion of 72% at 260℃ and a space velocity of 4 922 ml/(g·h).%二甲醚水蒸气重整制氢反应是燃料电池理想的供氢方式之一.探讨了二甲醚水蒸气重整过程中的反应与反应、反应与传热的耦合协同效应.采用二甲醚水解催化剂ZSM-5(硅铝比为25)和甲醇水蒸气重整催化剂(Cu-Zn系列及商用Cu-Zn-Al催化剂)混合制得二甲醚水蒸气重整的复合催化剂.在固定床反应装置中评价了催化剂活性并对催化剂进行了透射电镜、X射线衍射及N2吸附表征.结果表明,复合催化剂的活性除了受催化剂组成和铜含量的影响外,还与Al和Zr的量有关.在Cu:Zn摩尔比为60:30时,Al和Zr的同时加入使催化剂中Cu晶粒分散最好,催化剂具有较高的低温活性,二甲醚在空速为4 922 ml/(g·h)和260℃下的转化率达到72%.

  12. Influence of process conditions on methanol dehydration to dimethyl ether%工艺条件对甲醇脱水制二甲醚反应的影响

    Institute of Scientific and Technical Information of China (English)

    赵国良; 滕加伟; 金文清; 何万仁; 徐建军; 杨为民

    2015-01-01

    The process conditions of methanol dehydration to dimethyl ether(DME)on La / Al2 O3 catalyst was investigated in a simulated adiabatic fixed-bed reactor. The results indicated that methanol dehydration reaction was violent and the adiabatic temperature rise was about 130 ℃ when methanol inlet temperature was 210 ℃. The selectivity to DME was over 98% when the highest catalyst bed temperature was less than 380 ℃. Excessively high temperature resulted in the formation of a lot of byproduct methane. Reaction pres-sure had little influence on methanol dehydration reaction. Under the condition of methanol inlet temperature 240 ℃( the highest catalyst bed temperature 370 ℃),methanol space velocity 1. 5 h - 1 , reaction pressure 50 kPa,methanol conversion of over 84% and the selectivity to DME of more than 98. 5% were attained. The catalytic activity of La / Al2 O3 catalyst did not exhibit obvious change after running for 2 000 h.%以 La 改性氧化铝为催化剂,在模拟绝热固定床反应器中考察工艺条件对甲醇气相脱水制二甲醚反应的影响。结果表明,甲醇进料温度210℃时,甲醇脱水反应剧烈,绝热温升约130℃。催化剂床层热点温度低于380℃时,二甲醚选择性大于98%,过高温度产生大量副产物甲烷。反应压力对反应影响甚微。在甲醇进料温度240℃(热点温度370℃)、甲醇进料空速1.5 h -1和反应系统压力为50 kPa 条件下,甲醇转化率大于84%,二甲醚选择性大于98.5%,连续运转2000 h,催化剂无明显失活迹象。

  13. Thermodynamics of ethanol synthesis from dimethyl ether and syngas%二甲醚与合成气反应制乙醇的热力学计算与分析

    Institute of Scientific and Technical Information of China (English)

    薛晓军; 贾广信; 何俊辉; 李婷

    2014-01-01

    Both standard formation enthalpy and standard Gibbs free energy of dimethyl ether (DME) and methyl acetate were estimated with the Benson group contribution method. Reaction enthalpy change,reaction entropy change,reaction Gibbs free energy change and equilibrium constant of reactions of ethanol synthesis (DME carbonylation,MA hydrogenation,overall reactions) were calculated and analyzed. On this basis,effects of reaction temperature,reaction pressure,raw material ratio on DME conversion were investigated. The synergistic effect between the two reactions of ethanol synthesis were investigated at different concentrations of H2 under the conditions of 413K,normal pressure,CO∶DME=1. A moderate reaction temperature (lower than 493K),3MPa,n(CO)∶n(DME)=1 were beneficial to ethanol synthesis and the equilibrium conversion in MA hydrogenation increased greatly due to this synergistic effect.%采用Benson基团贡献法估算得到二甲醚(DME)和乙酸甲酯(MA)的标准生成焓和标准生成吉布斯自由能,在298~1000K时计算了DME与合成气制乙醇(DME羰基化反应、MA加氢反应以及二者组成的总反应)过程中的反应焓变、反应熵变、反应吉布斯自由能变和化学反应的平衡常数。在此基础上,分析了反应压力、反应温度和原料比对DME转化率的影响。在413K、1×105Pa、CO∶DME=1条件下考察了不同H2浓度情况下合成乙醇反应中两个反应的协同效应。分析结果表明,在低于493K、3MPa、n(CO)∶n(DME)=1的条件下有利于合成反应的进行,由于两反应的协同效应,使MA加氢反应的平衡转化率有大幅度提高。

  14. Dimethyl Ether in Diesel Fuel Injection Systems

    DEFF Research Database (Denmark)

    Sorenson, Spencer C.; Glensvig, M.; Abata, D. L.

    1998-01-01

    A study of the behaviour of DME in diesel injection systems. A discussion of the effects of compressibility of DME on compression work and wave propagation.DME spray shapes and penetration rates......A study of the behaviour of DME in diesel injection systems. A discussion of the effects of compressibility of DME on compression work and wave propagation.DME spray shapes and penetration rates...

  15. The Lubrication Qualities of Dimethyl Ether (DME)

    DEFF Research Database (Denmark)

    Sivebæk, Ion Marius; Sorenson, Spencer C; Jakobsen, J.

    2002-01-01

    recycling. A significant problem arises when conventional injection equipment is used for pumping DME: It breaks down prematurely due to the poor lubrication qualities of DME compared to those of diesel oil. These qualities consist of the lubricity, which is important in the boundary lubrication regime......, and the viscosity, which plays a major role in the hydrodynamic lubrication regime. The lubricity of DME has been established by the medium frequency pressurised reciprocating rig (MFPRR) to be very low compared to the one of diesel oil. But the DME film limits the wear extent significantly compared to the case...... of dry sliding. By mixing DME with additives, the lubricity level is easily raised even above the one of diesel oil. The viscosity of DME has been established by the volatile fuel viscometer (VFVM) to be as low as 0.185 cSt @ 25 oC. It is also shown that this viscosity cannot be raised significantly...

  16. Development of HCCI Engines for Dimethyl Ether

    DEFF Research Database (Denmark)

    Hansen, Kim Rene; Pedersen, Troels Dyhr; Schramm, Jesper

    This report has been prepared for the Danish Energy Agency. It summarizes the results of the project entitled: “Development of HCCI engines for DME”. The project has been financed by “EFP 06”. The chapters about theoretical and experimental studies have been written using the language...

  17. Development of alternative fuels from coal derived syngas. Topical report: Task 2.2, Demonstration of a one-step slurry-phase process for the production of dimethyl ether/methanol mixtures at the LaPorte Alternative Fuels Development Unit

    Energy Technology Data Exchange (ETDEWEB)

    1993-06-01

    This report documents engineering, modification, and operations efforts of demonstration of dimethyl-ether/methanol coproduction in a slurry-phase reactor, carried out in a 2-ft diameter bubble column reactor. Equipment modifications made it possible to remove the product DME and by-product CO{sub 2} from the reactor effluent. Coproduction of dimethyl-ether (DME) and methanol (MeOH) was accomplished in the slurry reactor by physically mixing two different catalysts. The catalyst used to produce MeOH from syngas was manufactured by BASF (type S3-86); the catalyst used to convert MeOH to DME was Catapal {gamma}-alumina. Ratio of MeOH to DME catalysts determined the selectivity towards DME. The demonstration sought to study effect of cocatalyst ratio on product selectivity. Three different proportions of DME catalyst were examined: 0, 6.6, and 19.3 wt % alumina. At each catalyst proportion, the plant was operated at two different gas space velocities. Some process variables were maintained at fixed conditions; most important variables included: reactor temperature (482F), reactor pressure (750 psig), and reactor feed gas composition (35% H{sub 2}, 51% CO,13% CO{sub 2} 1% other, nominal-molar basis).

  18. 磷改性双功能催化剂合成二甲醚性能研究%Study on performances of P-modified bifunctional catalyst for dimethyl ether synthesis

    Institute of Scientific and Technical Information of China (English)

    黄兵; 张世玲; 谢磊磊

    2011-01-01

    采用磷酸水溶液浸渍-焙烧法对甲醇脱水催化剂γ-Al2O3改性,得到磷改性甲醇脱水催化剂P-γ-Al2O3与C301甲醇合成催化剂以1:4的质量比混合制备成C301/p-γ-A12O3双功能催化剂用于一步法合成二甲醚,该改性双功能催化剂比未改性催化剂具有更高的催化活性.将该催化剂用于浆态床反应器,在p=3.7MPa,T=250℃,进料合成气n(H2)/n(CO)=2的条件下,CO转化率从93.11%提高到95.90%,DME选择性从34.61%提高到42.27%.改性催化剂经FT-IR、BET、XRD手段进行表征,发现在P-γ-Al2O3中增加了O=P-O键,使得脱水催化剂的表面总酸量和L酸中心数量同时增加,从而提高了双功能催化剂的活性.%Abifunctional catalyst (C301/P-γ-Al2O3) for one-step synthesis of dimethyl ether from syngas was prepared by the method as follows: γ-Al2O3 was modified by impregnation with phosphoric acid aqueous solution and calcination to obtain the P-γ-Al2O3, which was then mixed with the commercial methanol synthesis catalyst C301 in a mass ratio of 1:4. The P-modified catalyst had higher activity than the unmodified catalyst. The modified catalyst was used in a slurry bed reactor and the conversion of CO increased from 93.11% to 95.90% while the DME selectivity increased from 34.61% to 42.27% under pressure of 3.7MPa, temperature of 250°C and feed gas HVCO molar ratio of 2. The P-γ-Al2O3 catalyst was characterized by FT-IR, XRD and BET, and it was found that the 0=P-0 bond existed in the P-γ-Al2O3, which made the numbers of both total acid and L acid sites of the P-γ-A12O3 surface increased that resulted in the improvement of the activity of the prepared bifunctional catalyst.

  19. 车载等离子体重整二甲醚制氢系统性能提高途径%Approaches to Improve Performances of Onboard Hydrogen Production by Plasma Reforming of Dimethyl Ether

    Institute of Scientific and Technical Information of China (English)

    马奎峰; 刘宁博; 宋凌琚; 李兴虎

    2012-01-01

    应用自制的车载等离子体富氢气体制备装置和二甲醚(DME)部分氧化重整制氢实验测量系统,进行了利用排气余热提高该反应氢产率的研究.考察了反应温度、空/醚体积比(VA/VD)和Fe基催化剂对系统性能的影响.结果表明,随着反应温度的升高,DME部分氧化重整制氢反应的DME转化率逐渐升高,H2产率先增大后减小,650℃时达最大值20.3%;温度保持为600℃时,随着VA/VD的增加,氢产率先增加后减小,在VA/VD=3.0时,H2产率取得最高值22.2%;提高温度可降低对过量空气的依赖,但高温下H2选择性小于常温下的;温度超过500℃后,以活性炭为载体的Fe基催化剂能够显著提高部分氧化的反应速率,从而提高H2产率和DME转化率.利用发动机排气废热可以提高制氢系统的综合性能,但反应温度不宜超过650℃.%Experiments of hydrogen production by partial reforming of dimethyl ether(DME) with recycle of exhaust heat were carried out by using self-made measurement system and onboard plasma system. The effects of heating temperature, air-to-DME volume ratio (VA/VD) and Fe-based catalyst on H2 yield, DME conversion rate, H2 selectivity and energy consumption were investigated. The results indicated that with the increase of heating temperature, the DME conversion rate was increased, the H2 yield increased first and then decreased, with the maximal value of 20. 3% at 65O°C. At 600°C , with the increase of VA/Vn, the H2 yield increased initially and then decreased, with the maximal value of 22. 2% at Va/Vd of 3.0. The optimal VA/VD for the highest H2 yield could be decreased by heating method, but the H2 selectivity was decreased. The Fe-based catalyst clearly improved the reaction velocity when temperatures were beyond 500°C , and the H2 yield and DME conversion were both increased with the increase of heating temperature. The comprehensive performance of onboard hydrogen production system could be

  20. Synthesis of Dimethyl Ether over C301/P-γ-Al2O3 Catalyst%C301/P-γ-Al2O3双功能催化剂一步合成二甲醚

    Institute of Scientific and Technical Information of China (English)

    陈樑; 章江洪; 张世玲; 谢磊磊

    2011-01-01

    利用磷酸浸渍改性甲醇脱水催化剂γ-Al2O3得到的P-γ-Al2O3与甲醇合成催化剂C301制备双功能催化剂(C301/P-γ-Al2O3).以C301/P-γ-Al2O3为催化剂,液体石蜡为溶剂,在浆态床反应器中研究合成气一步法制二甲醚(DME),考察了反应温度、压力、空速和合成气中的CO2含量对一步法制DME的影响.结果表明,反应温度、压力、空速及合成气中的CO2含量对合成DME均有较大影响,磷改性双功能催化剂可适应含CO2的合成气制DME,并可提高DME选择性,增加DME收率.在液体石蜡150 mL,催化剂用量为溶剂质量的7.3%,氢和一氧化碳物质的量之比为2,反应温度为270℃,反应压力4.3 MPa和空速为600 mL/(h·g)的条件下,CO单程转化率可达到93%以上,DME选择性大于60%.该催化剂的稳定性比较好,可承受较宽的温度、压力和空速的波动范围.%The bi-fiinction catalyst(C301/P-y-Al2O3) was prepared from P-y-Al2O3 obtained by modifying methanol dehydration catalyst y-Al2O3 through phosphorus acid dipping method and methanol synthesis catalyst C301. The effects of reaction temperature, reaction pressure, space velocity and CO2 content in the syngas on the catalytic performance of C301/P-y-Al2O3 for synthesis of dimethyl ether(DME) from syngas by one step method over C301/P-y-Al2O3(mass ratio of C301 to P-y-Al2O3 4) using liquid paraffin as solvent were investigated in the slurry bed. The results showed that the conversion of CO2 and the selectivity of DME reached 93% and 60%, respectively, under the conditions of liquid paraffin 150 mL, mass ratio of catalyst to liquid paraffin 7.3%, molar ratio of H2 to CO 2, reaction temperature 270 ℃, reaction temperature 4.3 Mpa, space velocity 600 mL/(hg). The conversion of total carbon(CO and CO2) and CO decreased, conversion of H2, selectivity and yield of DME increased when CO2 was added to syngas. The bi-function catalyst exhibited relatively stable catalytic performance in a wide

  1. Simulation and Optimization of Quench-Type Multiple Fixed-bed Reactor for Producing Dimethyl Ether via Methanol Vapor Phase Dehydration%甲醇气相脱水制二甲醚多段原料气冷激反应器模拟与优化

    Institute of Scientific and Technical Information of China (English)

    杨学萍; 刘殿华; 杨为民

    2012-01-01

    Upon the demand of megaton DME (dimethyl ether) production, a kinetics of gas dehydration of methanol to dimethyl ether was developed and a fixed bed reactor model with multi-segment feed quenches was established. The model could predict the concentration and temperature distribution along the axial direction in the bed. Through the reactor simulation and model sensitivity analysis, a set of process parameters was optimized. The optimal operating condition requires three stage feed-quenches with methanol allocation of 7:2:1; the outlet temperature at each stage is almost the same with the maximum outlet temperature of 360℃. The result shows that a lower quench-gas temperature does not always result in a better reactor performance. When the inlet and quench temperature are 260.0 ℃ and 140.0℃ respectively, methanol conversion and dimethyl ether yield reach the maximum values.c%针对百万吨级二甲醚生产的要求,建立了甲醇气相脱水制二甲醚的反应动力学模型以及多段原料气冷激的固定床反应器模型,并模拟计算得到甲醇制二甲醚过程中反应器浓度与温度的轴向分布.通过改变操作条件对反应器的参数敏感性进行分析,结果发现,甲醇原料气分为三段进入反应器较为合适,入口气量分配比例最好为7∶2∶1,此时反应器最高出口温度略高于360℃,各段出口温度大致相当,分布较合理;冷激气温度并非越低越有利,当二段入口温度低于催化剂起活温度就没有意义了,在入口甲醇原料温度为260℃、冷激气温度为140.0℃时,甲醇总转化率利二甲醚产量达到最大值.

  2. Cosmic Ether

    CERN Document Server

    Tomaschitz, R

    1998-01-01

    A prerelativistic approach to particle dynamics is explored in an expanding Robertson-Walker cosmology. The receding galactic background provides a distinguished frame of reference and a unique cosmic time. In this context the relativistic, purely geometric space-time concept is criticized. Physical space is regarded as a permeable medium, the cosmic ether, which effects the world-lines of particles and rays. We study in detail a Robertson-Walker universe with linear expansion factor and negatively curved, open three-space; we choose the permeability tensor of the ether in such a way that the semiclassical approximation is exact. Galactic red-shifts depend on the refractive index of the ether. In the local Minkowskian limit the ether causes a time variation of mass, which scales inversely proportional to cosmic time. In the globally geodesic rest frames of galactic observers the ether manifests itself in an unbounded speed of signal transfer, in bifurcations of world-lines, and in time inversion effects.

  3. Synthesis of dimethyl ether by hydrogenation of CO2 catalyzed by CuO-ZnO-Al2O3/montmorillonite%CuO-ZnO-Al2O3/蒙脱土催化二氧化碳加氢合成二甲醚

    Institute of Scientific and Technical Information of China (English)

    查飞; 马小茹; 陈浩斌; 丁健; 李治霖

    2013-01-01

    Catalyst of CuO-ZnO-Al2O3/montinorillonite was prepared by supporting CuO-ZnO-Al2O3 with acidified montmorillonite. The catalyst structure was characterized by the methods of BET, FT-IR and XRD. Catalytic activity of CuO-ZnO-Al2O3/montmorillonite for the synthesis of dimethyl ether by hydrogenation of CO2 was studied in the fixed-bed reactor. The effects of acidity of HC1, the reaction temperature, pressure and volume ratio of H2 /CO2 were investigated at mixed gases feed speed of 1 600 h-1 and mass ratio of montmorillonite : CuO-ZnO-Al2O3=3:7.With lmol/L HC1 acidified montmorillonite, under the conditions of pressure at 3 MPa, temperature at 545 K and H2/CO2 is 3/1 (volume ratio), the conversion of CO2 is 26.5%, the total yield of dimethyl ether and methanol is 15.7%, the selectivity and yield of dimethyl ether can be reached to 16.7% and 4.4%, respectively.%摘 要:采用盐酸酸化的蒙脱土负载共沉淀法制备的CuO-ZnO-Al2O3,制备了CuO-ZnO-Al2O3/蒙脱土催化剂,用BET、FT-IR和XRD对催化剂结构进行了表征,并在固定床微型反应器中研究了其对二氧化碳加氢制备二甲醚的催化活性,在反应混合气空速为1 600 h-1,蒙脱土:CuO-ZnO-A12O3=3:7(质量比)的条件下,测定了酸化浓度、反应温度、压力和H2/CO2体积比对催化活性的影响.结果表明,用1 mol/L HC1酸化蒙脱土,反应温度为545K,反应压力为3 MPa,H2/CO2体积比为3时,CO2的单程转化率达到26.5%,二甲醚的选择性和收率分别为16.7%和4.4%,甲醇和二甲醚的总收率达到15.7%.

  4. 合成气直接合成二甲醚与甲醇的热力学分析%Thermodynamic Analysis for Synthesis of Dimethyl Ether and Methanol from Synthesis Gas

    Institute of Scientific and Technical Information of China (English)

    张海涛; 曹发海; 刘殿华; 房鼎业

    2001-01-01

    确定了合成气直接合成二甲醚与甲醇的复合反应体系独立方程数,并进行了热力学计算与分析,计算了不同初始组成、温度、压力下复合反应体系的平衡组成及平衡条件下二甲醚与甲醇的选择率。%Thermodynamic analysis is carried out for the compound reaction system of diethyl ether and methanol from synthesis gas. The equilibrium composition and the selectivities in equilibrium are calculated for different initial compositions, temperature and pressure.

  5. 煤基合成气一步制备高纯度二甲醚的全流程建模与模拟%Modeling and Simulation of Production Process on Dimethyl Ether Synthesized from Coal-based Syngas by One-step Method

    Institute of Scientific and Technical Information of China (English)

    韩嫒嫒; 张海涛; 应卫勇; 房鼎业

    2009-01-01

    As a result of shortage supply of oil resources, the process for the alternative coal-based fuel, dimethyl ether (DME), has emerged as an important process in chemical engineering field. With the laboratory experiment data about DME synthesis and separation, the production process for DME with high purity is proposed when one-step synthesis of DME in slurry bed reactor from syngas is adopted. On the basis of experimental research and process analysis, the proper unit modules and thermophysical calculation methods for the simulation process are selected. Incorporated the experimentally determined parameters of reaction dynamic model for DME synthesis, regression constants of parameters in non-random two-liquid equation (NRTL) model for binary component in DME separation system with built-in properties model, the process flowsheet is developed and simulated on the Aspen Plus platform. The simulation results coincide well with data obtained in laboratory experiment. Accordingly, the accurate simulation results offer useful references to similar equipment design and process operation optimization.

  6. Steam Reforming of Dimethyl Ether over Coupled Catalysts of CuO-ZnO-Al2O3-ZrO2 and Solid-acid Catalyst%二甲醚水蒸气重整制氢CuO-ZnO-Al2O3-ZrO2/固体酸复合催化剂

    Institute of Scientific and Technical Information of China (English)

    冯冬梅; 左宜赞; 王德峥; 王金福

    2009-01-01

    Steam reforming (SR) of dimethyl ether (DME) was investigated for the production of hydrogen for fuel cells. The activity of a series of solid acids for DME hydrolysis was investigated. The solid acid catalysts were ZSM-5[Si/Al= 25, 38 and 50: denoted Z(Si/Al)] and acidic alumina (γ-Al2O3) with an acid strength order that was Z(25)>Z(38)>Z(50)>γ-Al2O3. Stronger acidity gave higher DME hydrolysis conversion. Physical mixtures containing a CuO-ZnO-Zl2O3-ZrO2 catalyst and solid acid catalyst to couple DME hydrolysis and methanol SR were used to examine the acidity effects on DME SR. DME SR activity strongly depended on the activity for DME hydrolysis. Z(25) was the best solid acid catalyst for DME SR and gave a DME conversion>90% [T= 240℃,n(H2O)/n(DME) = 3.5, space velocity = 1179 ml·(g cat) -1·h-1, and P= 0.1MPa]. The influences of the reaction temperature, space velocity and feed molar ratio were studied. Hydrogen production significantly depended on temperature and space velocity. A bifunctional catalyst of CuO-ZnO-Al2O3-ZrO2 catalyst and ZSM-5 gave a high H2 production rate and CO2 selectivity.

  7. 浅析二甲醚代替LPG用于工业生产的可行性%Analysis of Dimethyl Ether Instead of LPG for Industrial Production Feasibility

    Institute of Scientific and Technical Information of China (English)

    庞艳勇; 苏志强

    2011-01-01

    Dimethyl ether(DME) fuel and the physical and chemical properties and combustion mechanism of LPG from petrochemical products were similar.With the shortage of resources,liquefied petroleum gas prices and other economic issues,and the in-depth of clean and environmental,DME as a a new kind of clean fuel would be gradually replaced of LPG to be one of the main fuel in market.The application of DME and the physical and chemical properties were described,highlighenting the combustion mechanism of DME and the calculation of thermodynamic properties,and the transformation process of DME instead of LPG was proposed.%二甲醚(DME)与石油化工中的燃料产品LPG的物理化学性质和燃烧机理相似,随着液化石油气资源的紧缺及价格上涨等经济问题的加重和清洁环保理念的深入,DME作为一种新兴的清洁燃料将会逐步代替LPG,占领燃料市场的一席之地。本文阐述了DME的应用和物理化学性质,着重介绍了DME的燃烧机理和热力学性质的计算,并提出了DME代替LPG需要的工艺改造。

  8. Catalytic performance of boehmite catalysts for methanol dehydration to dimethyl ether in slurry reactor%勃姆石催化浆态床甲醇脱水制二甲醚

    Institute of Scientific and Technical Information of China (English)

    王瑞; 郭彦鑫

    2015-01-01

    Using a1uminium isopropoxide as the raw materia1,boehmite s1urry cata1ysts for methano1 dehydration to dimethy1 ether were prepared by comp1ete 1iquid-phase method. The as-prepared cata1ysts were characterized by XRD,NH3-TPD and XPS. The activity of boehmite s1urry cata1ysts for methano1 dehydration to dimethy1 ether were eva1uated in a s1urry reactor,and the inf1uence of the amounts of water and acid were investigated. The resu1ts showed that the as-prepared boehmite s1urry cata1ysts possessed better activity and boehmite phase structure. Under the preparation condition of n(HNO3 )∶ n(a1uminium isoprop-oxide)= 0.3∶1 and n(H2O)∶ n(a1uminium isopropoxide)=50∶1,the obtained cata1yst had the best activity.%以异丙醇铝为原料,采用完全液相法制备勃姆石系列甲醇脱水浆状催化剂,通过 XRD、NH3- TPD和 XPS 等对催化剂的结构和酸性质进行表征,并在浆态床条件下评价其甲醇脱水生成二甲醚的活性,考察水量和酸量对催化剂活性的影响。结果表明,制备的浆状勃姆石催化剂具有良好的活性,相结构为勃姆石。在硝酸与异丙醇铝物质的量比为0.3∶1和水与异丙醇铝物质的量比为50∶1条件下,制备的催化剂活性最高。

  9. Al2O3 Effect on the Catalytic Activity of Cu-ZnO-Al2O3-SiO2 Catalysts for Dimethyl Ether Synthesis from CO2 Hydrogenation

    Institute of Scientific and Technical Information of China (English)

    Jiyuan Wang; Chongyu Zeng

    2005-01-01

    by a pseudo sol-gel method has been investigated and these catalysts were characterized by XRD,H2-TPR,XPS,NH3-TPD and CO2-TPD techniques. As revealed by XRD and H2-TPR,the added alumina produces high dispersion of CuO and makes the reduction of CuO difficult. XPS analysis detects a remarkably high Al3+ enrichment at the surface of calcined samples,along with a decrease of Eb of Cu 2p3/2,which confirms the Cu-Al interaction.Another important role of Al2O3 would be to incorporate into the SiO2 structure to form the acid-base sites for ether formation. The reaction results shows that the addition of Al2O3 exhibits a promoting effect on the CO2 conversion only when its content is below 1.4%,and an optimal DME selectivity is obtained when 4.0%Al2O3 is added,indicating a better 'synergistic effect' is present between the methanol forming component and the acidic component in bifunctional catalysts. Possible relationship between the catalytic activity and the Cu-Al interaction as well as the surface acidity is discussed.

  10. Method of operating a direct dme fuel cell system

    DEFF Research Database (Denmark)

    2011-01-01

    The present invention relates to a method of operating a fuel cell system comprising one or more fuel cells with a proton exchange membrane, wherein the membrane is composed of a polymeric material comprising acid-doped polybenzimidazole (PBI). The method comprises adjusting the operating...

  11. Method of operating a direct dme fuel cell system

    DEFF Research Database (Denmark)

    2011-01-01

    The present invention relates to a method of operating a fuel cell system comprising one or more fuel cells with a proton exchange membrane, wherein the membrane is composed of a polymeric material comprising acid-doped polybenzimidazole (PBI). The method comprises adjusting the operating...

  12. Mechanical properties and chemical stability of pivalolactone-based poly(ether ester)s

    NARCIS (Netherlands)

    Tijsma, E.J.; Does, van der L.; Bantjes, A.; Vulic, I.

    1994-01-01

    The processing, mechanical and chemical properties of poly(ether ester)s, prepared from pivalolactone (PVL), 1,4-butanediol (4G) and dimethyl terephthalate (DMT), were studied. The poly(ether ester)s could easily be processed by injection moulding, owing to their favourable rheological and thermal p

  13. Difference between reactions of methanol-to-gasoline and dimethyl ether-to-gasoline catalyzed by Fe-ZSM-5%甲醇和二甲醚在Fe-ZSM-5催化剂上转化制汽油的异同

    Institute of Scientific and Technical Information of China (English)

    周小龙; 刘广波; 韩文玉; 李建青; 吴晋沪

    2015-01-01

    Synthesis of gasoline using dimethyl ether (DME) and methanol as feedstock, respectively, over an in-situ synthesized Fe-ZSM-5 catalyst was investigated. The results indicated that different reactant had different gasoline yield, gasoline quality and catalyst lifetime. Using methanol and DME as the reactant, the highest gasoline mass yield was 29.7%and 35.4%, respectively. The oil quality was different for different reactant because of their different aromatics distribution, and the catalyst lifetime was about 40%longer for methanol feedstock than that for DME feedstock, which was attribute to the difference of reaction rate for the two reactants and the formation of water when using methanol as feedstock having an additional hydrothermal effect to the catalyst and inhibiting coke formation.%分别以二甲醚和甲醇为原料对原位合成Fe-ZSM-5催化剂进行了制汽油评价。结果表明以这两种原料制汽油有着不同的油收率、油品质和催化剂寿命。以甲醇和二甲醚为原料时最高油收率分别为29.7%和35.4%,油品质的不同表现为相同时间段的产品油芳烃分布不同,以甲醇为原料时催化剂寿命比以二甲醚为原料时高40%左右。这可能是由于两反应有不同的反应速率常数,甲醇脱水对分子筛催化剂的水热反应和额外的水对催化剂积炭的抑制等因素造成的。

  14. 合成方法对于生物质合成气一步法合成二甲醚催化剂性能的影响%Study on Synthesis Method on Catalytical Performance of Catalysts for Direct Synthesis of Dimethyl Ether from Bio-syngas

    Institute of Scientific and Technical Information of China (English)

    徐海燕; 雷廷宙; 任素霞; 何晓峰; 朱金陵

    2012-01-01

    以Cu-ZnO-Fe2O3-ZrO2作为甲醇合成活性组分并以HZSM-5作为甲醇脱水活性组分用3种不同的方法合成了催化剂,对催化剂进行了XRD和BET表征.研究了3种合成方法对于生物质合成气一步法制二甲醚Cu-ZnO-Fe2O3-ZrO2/HZSM-5催化剂催化性能的影响,结果表明,合成方法对于活性组分的分散度有很大的影响,从而进一步影响催化剂对于该反应的催化活性及目标产物的选择性.%Three catalysts were synthesized using Cu —ZnO -Fe2O3 — ZrO2 as methanol synthesis component and HZSM-5 as methanol dehydration component. The catalysts were characterized using X-ray diffraction (XRD), and Brunauer-Emmett-Teller (BET) surface area techniques. Synthesis methods on catalytical performance of catalysts for direct synthesis of dimethyl ether from bio—syngas were studied. The results show that synthesis methods have great impact on the dispersity of active components of the catalysts, and then affecting the conversion of CO and selectivity of DME for this reaction.

  15. 完全液相法催化剂上甲醇脱水合成二甲醚的动力学及DFT研究%Kinetics and DFT study of complete liquid-phase catalyst for dehydration of methanol to dimethyl ether

    Institute of Scientific and Technical Information of China (English)

    胡建水; 王程俊; 刘雷; 左志军; 黄伟; 谢克昌

    2012-01-01

    The kinetics and density functional theory (DFT) of dimethyl ether (DME) synthesis from methanol dehydration over A100H catalysts prepared by complete liquid phase method in a slurry bed reactor was investigated. The kinetic model showed that the rate-limiting step of CH3OH dehydration over A1OOH catalysts was coadsorption of two methanol molecules. The process of DME synthesis from methanol dehydration over A1OOH (100) surface in liquid paraffin was also studied with DFT, and the reaction process and activation energy of the rate-limiting step were consistent with the kinetic model, further indicating that the model could reasonably describe the process of DME synthesis from methanol dehydration over A1OOH catalysts by complete liquid phase method.%采用完全液相法制备AlOOH催化剂并进行了浆态床反应器中甲醇脱水制备二甲醚的反应动力学和DFT的研究.在3种甲醇脱水制备二甲醚的反应机理中,以表面反应即两个同时吸附的甲醇反应生成二甲醚作为速控步骤,所建立动力学模型的计算值和实验值吻合较好.采用DFT计算了液体石蜡环境中AlOOH (100)面的脱水反应,其反应过程和活化能结果与动力学模型结果基本一致,进一步表明采用该模型可以合理描述完全液相法制备的AlOOH催化剂表面甲醇脱水反应过程.

  16. Recent advances in the activation of carbon dioxide and the synthesis of dimethyl ether by the catalytic hydrogenation of carbon dioxide%二氧化碳的活化及其催化加氢制二甲醚的研究进展

    Institute of Scientific and Technical Information of China (English)

    秦祖赠; 刘瑞雯; 纪红兵; 蒋月秀

    2015-01-01

    CO2是一种稳定的物质,其化学惰性限制了 CO2转化技术的发展。本文介绍了化学催化、生物活化、光电活化及等离子体活化等 CO2活化方式,从 CO2催化加氢合成二甲醚的工艺研究、催化剂开发、催化加氢机理和本征动力学研究等方面综述了 CO2催化加氢合成二甲醚的研究进展,认为化学催化法是目前应用最广泛的一种CO2活化方式。对于一步法催化CO2加氢合成二甲醚的工艺,其难点是制备高效CO2活化催化剂。开发高效的CO2活化及转化催化剂及对CO2合成二甲醚的反应过程进行机理探究,是推广CO2转化技术的关键。%CO2 is a kind of stable substance,and its chemical inertness limits the development of CO2 conversion technologies. This paper describes the activation methods of CO2,including chemical catalysis,biological activation,photoelectric activation and plasma activation. The recent advances are reviewed by introducing the study on dimethyl ether ( DME ) synthesis from the catalytic hydrogenation of CO2,the development of catalysts,the mechanism of catalytic hydrogenation process and intrinsic kinetics. It is pointed out in the paper that the method of chemical catalysis is the most widely used method of CO2 activation. To develop effective activation catalysts of CO2 is the difficulty in the one-step process of DME synthesis by the catalytic hydrogenation of CO2. The development of effective activation and conversion catalysts of CO2 and the mechanism exploration of DME synthesis reaction are the keys to the promotion of CO2 conversion technologies.

  17. Experiment on Bi-functional Catalyst of Dimethyl Ether Steam Reforming for Hydrogen Production%CuMn2O4/HZSM-5催化二甲醚水蒸气重整制氢的试验研究

    Institute of Scientific and Technical Information of China (English)

    吴娇; 黄鹏; 陈晓玲; 周相满; 张武高

    2012-01-01

    搭建了二甲醚水蒸气重整制氢的小样模拟台架,并制备了二甲醚重整制氢催化剂.研究了不同水解活性组分、甲醇重整活性组分和煅烧温度下的尖晶石复合催化剂对二甲醚水蒸气催化重整制氢性能的影响.结果发现:不同水解活性组分中,HZSM-5(硅铝摩尔比r=n(SiO2)/n(Al2O3)=38)的双功能催化剂的H。产率最高;甲醇重整活性组分中,铜锰尖晶石结构催化组分(CuMn2O4)的双功能催化剂的H2产率最高;煅烧温度对CuMn2O4双功能催化剂的催化效果有明显影响,其中煅烧温度为700℃时H2产率最高.%The performance of catalysts prepared by mechanically mixing dimethyl ether (DME) hydrolysis active components and methanol reforming active components were compared in the DME steam reforming reaction. The effects of different active components and different calcination temperatures of Cu-Mn-spinel were studied. The results show that HZSM-5 (nSiO2/nAl2O3 = 38) has the highest H2 production rate among different DME hydrolysis active components. Cu-Mn-spinel has high H2 production among different methanol reforming active components. Cu-Mn-spinel that was calcined by 700 ℃ exhibits the highest activity for DME steam reforming. The result shows that DME conversion is 99.65% and H2 production is 73.15% at 350 ℃ when used the hi-functional catalyst composed of Cu-Mn-spinel(700 ℃) and HZSM-5 (38). The study is very important for fuel design of DME engine.

  18. 聚甲氧基二甲醚火(PODEn)引燃时刻对HCII燃烧与排放的影响%Effects of induced injection-timing on combustion and emission performances in homogeneous-charge-induced-ignition (HCII) combustion by using polyoxymethylene dimethyl ethers (PODEn)

    Institute of Scientific and Technical Information of China (English)

    刘浩业; 王志; 王建昕

    2016-01-01

    Combustion, emission characteristics and thermal efifciency were investigated under various induced injection-timing for a Homogeneous Charge Induced Ignition (HCII) to improve the thermal efifciency and reduce soot emissions from under-mixing induced diesel. The tests were conducted in an HCII principle engine using 0%, 50%and 100%volume friction polyoxymethylene dimethyl ethers (PODEn)/diesel blend as induced fuel. The results show that adding PODEn can signiifcantly reduce the hydrocarbons (HC), nitric oxide (CO) emissions, and the Coefifcient of Variation (COV) and can increase indicated thermal efifciency at the condition of 1 200 r/min, 0.3 MPa of Indicated Mean Effective Pressure (IMEP), the HCII induced by 100%PODEn even has higher thermal efifciency than diesel Direct-Injection mode;and that adding PODEn can signiifcantly reduce exhaust smoke and increase indicated thermal efifciency at the condition of 1 600 r/min, 0.6 MPa of IMEP.%为提高均质混合气引燃(HCII)的效率并降低由于引燃柴油预混不充分产生的碳烟排放,在一台HCII原理性单缸机上,分别使用体积分数为0%、50%和100%的聚甲氧基二甲醚(PODEn)/柴油混合燃料作为引燃燃料研究了在不同引燃燃料喷油时刻下HCII燃烧的燃烧、排放特性和热效率。结果表明:在1200 r/min,0.3 MPa指示平均有效压力(IMEP)工况下,向引燃燃料中添加PODEn能够明显降低碳氢化合物(HC)、一氧化碳(CO)排放以及循环变动(COV),提高指示热效率,100%的PODEn作为引燃燃料时HCII燃烧模式的指示热效率达到甚至超过柴油直喷模式;在1600 r/min,0.6 MPa IMEP工况下,向引燃燃料中添加PODEn能够明显降低排气光吸收系数,提高指示热效率。

  19. Dimethyl Ether as a Fuel for Diesel Engines

    DEFF Research Database (Denmark)

    Sorenson, Spencer C.

    1999-01-01

    DME has recently been shown to be an attractive high cetane fuel for diesel engines, offering the advantages of soot free operation, with low engine noise, the potential for low NOx emissions, and low reactivity emissions of hydrocarbons and unburned fuel. DME has physical characteristics similar...... of engine fuels systems in regard to lubricity and suitable sealing materials....

  20. Numerical modeling of dimethyl ether (DME) bubble growth and breakup

    Institute of Scientific and Technical Information of China (English)

    ZHANG Peng; ZHANG YuSheng

    2009-01-01

    A numerical program is written to simulate the process of vapor bubble growth with spherical symmetry from the thermodynamic critical radius in an initially uniformly superheated liquid. The program is validated by the experimental data of superheated water. The calculated results agree with those of experiments well. The program takes into account the variations of properties with temperature precisely to simulate the DME bubble growth under flash boiling conditions. Considering the influences of pressure, surface tension and viscous stress, the linear stability analysis method is adopted to deduce the dispersion equation to represent the disturbance development during the bubble growth, and a new criterion for bubble breakup is established. The results show the bubble becomes more unstable with the increase of bubble Weber number and void fraction, and that with the increase of bubble growth rate or the decrease of initial radius ration of droplet to bubble, the breakup time of bubble becomes shorter.

  1. Homogeneous Charge Compression Ignition Combustion of Dimethyl Ether

    DEFF Research Database (Denmark)

    Pedersen, Troels Dyhr

    mechanism greatly reduces both. Reaction paths for methanol and methane were included amongst the elementary reactions, since these two fuels are commonly used to control the radical behavior in the initial phase of combustion and hence the combustion phasing of the fuel in an engine, as well as enabling...... an increase in engine power. The use of methanol for combustion phasing control was tested successfully in a large diesel engine with common rail, in which the piston bowls were widened to give a compression ratio of 14.5. This compression ratio still allows DI CI operation with DME, but requires...... a substantial combustion delay in HCCI operation with DME to achieve post TDC combustion. By adding methanol to the inlet port during HCCI combustion of DME, the engine reached 50 percent of its full DI CI load capability without engine knock at 1000 rpm and somewhat less at 1800 rpm. The engine also had EGR...

  2. Application of Dimethyl Ether in Compression Ignition Engines

    DEFF Research Database (Denmark)

    Hansen, Kim Rene

    -Marathon. The diesel engine test results from 1995 showed that DME is a superb diesel fuel. DME is easy to ignite by compression ignition and it has a molecular structure that results in near-zero emission of particulates when burned. These are features of a fuel that are highly desirable in a diesel engine....... The challenges with DME as a diesel engine fuel are mainly related to poor lubricity and incompatibility with a range of elastomers commonly used for seals in fuel injection systems. This means that although DME burns well in a diesel engine designing a fuel injection system for DME is challenging. Since...... then studies have revealed that the injection pressure for DME does not have to be as high as with diesel to achieve satisfactory performance. This opens for a larger range of possibilities when designing injection systems. In the period from 2004 to 2009 the DME engine was perfected for use in the car DTU...

  3. Dimethyl ether as alternative fuel for CI engine and vehicle

    Institute of Scientific and Technical Information of China (English)

    Zhen HUANG; Xinqi QIAO; Wugao ZHANG; Junhua WU; Junjun ZHANG

    2009-01-01

    As a developing and the most populous country in the world, China faces major challenges in energy supply and environmental protection. It is of great importance to develop clean and alternative fuels for internal combustion engines. On the basis of researches on DME engine and vehicle at Shanghai Jiaotong University in the last twelve years, fuel injection, combustion, performance and exhaust emissions of DME engine and DME vehicle are introduced in this paper. The results indicate that DME engines can achieve high thermal efficiency and ultra low emissions, and will play a significant role in meeting the energy demand while minimizing environmental impact in China.

  4. Process Design and control of dimethyl ether synthesis

    OpenAIRE

    Martín Méndez, Laura

    2016-01-01

    El objetivo principal de este Trabajo de Fin de Grado es el diseño del proceso de producción de dimetil éter (DME) y su posterior simulación con la ayuda del programa Aspen Plus ®. Además también se ha implementado el control del proceso, como se muestra en el diagrama de tuberías e instrumentos o diagrama P&I. Los principales usos y aplicaciones del dimetil éter son: combustible en plantas de generación de energía, sustituto o complemento del gas licuado de petróleo, combustible en motores d...

  5. An Investigation of Flow in Nozzle Hole of Dimethyl Ether

    Science.gov (United States)

    Kato, M.; Yokota, T.; Weber, J.; Gill, D.

    2015-12-01

    For over twenty years, DME has shown itself to be a most promising fuel for diesel combustion. DME is produced by simple synthesis of such common sources as coal, natural gas, biomass, and waste feedstock. DME is a flammable, thermally-stable liquid similar to liquefied petroleum gas (LPG) and can be handled like LPG. However, the physical properties of DME such as its low viscosity, lubricity and bulk modulus have negative effects for the fuel injection system, which have both limited the achievable injection pressures to about 500 bar and DME's introduction into the market. To overcome some of these effects, a common rail fuel injection system was adapted to operate with DME and produce injection pressures of up to 1000 bar. To understand the effect of the high injection pressure, tests were carried out using 2D optically accessed nozzles. This allowed the impact of the high vapour pressure of DME on the onset of cavitation in the nozzle hole to be assessed and improve the flow characteristics.

  6. Structure and Reactivity of Alkyl Ethers Adsorbed on CeO(2)(111) Model Catalysts

    Energy Technology Data Exchange (ETDEWEB)

    Calaza, Florencia C [ORNL; Chen, Tsung-Liang [ORNL; Mullins, David R [ORNL; Overbury, Steven {Steve} H [ORNL

    2011-01-01

    The effect of surface hydroxyls on the adsorption of ether on ceria was explored. Adsorption of dimethyl ether (DME) and diethyl ether (DEE) on oxidized and reduced CeO{sub 2}(111) films was studied and compared with Ru(0001) using RAIRS and sXPS within a UHV environment. On Ru(0001) the ethers adsorb weakly with the molecular plane close to parallel to the surface plane. On the ceria films, the adsorption of the ethers was stronger than on the metal surface, presumably due to stronger interaction of the ether oxygen lone pair electrons with a cerium cation. This interaction causes the ethers to tilt away from the surface plane compared to the Ru(0001) surface. No pronounced differences were found between oxidized (CeO{sub 2}) and reduced (CeOx) films. The adsorption of the ethers was found to be perturbed by the presence of OH groups on hydroxylated CeOx. In the case of DEE, the geometry of adsorption resembles that found on Ru, and in the case of dimethyl ether DME is in between that one found on clean CeOx and the metal surface. Decomposition of the DEE was observed on the OH/CeOx surface following high DEE exposure at 300 K and higher temperatures. Ethoxides and acetates were identified as adsorbed species on the surface by means of RAIRS and ethoxides and formates by s-XPS. No decomposition of dimethyl ether was observed on the OH/CeOx at these higher temperatures, implying that the dissociation of the C-O bond from ethers requires the presence of {beta}-hydrogen.

  7. MoO3-SnO2催化剂上二甲醚低温氧化高选择性制备甲酸甲酯%Low-temperature oxidation of dimethyl ether to methyl formate with high selectivity over MoO3-SnO2 catalysts

    Institute of Scientific and Technical Information of China (English)

    刘广波; 张清德; 韩怡卓; 椿范立; 谭猗生

    2013-01-01

    定向设计并制备了多功能MoO3-SnO2催化剂,在常压连续流动固定床反应器上实现了二甲醚低温氧化高选择性制备甲酸甲酯的过程.考察了机械混合法、共沉淀法及沉淀浸渍法等不同制备方法对催化剂性能的影响.在沉淀浸渍法制备的MoO3-SnO2催化剂上,常压、160℃反应条件下,甲酸甲酯选择性达94.1%,DME转化率也达到了33.9%,并且产物中无COx生成.采用NH3-TPD、CO2-TPD及H2-TPR对催化剂进行了表征,结果表明,表面酸性、碱性及氧化性的不同是造成催化剂反应性能差异的原因.另外,通过采用XRD、Raman及TEM对催化剂结构进行表征发现,晶粒粒径及金属氧化物MoO3的存在状态等结构的差异是造成催化剂活性不同的主要原因.较小晶粒的催化剂和表面存在的低聚态MoO3是致使催化剂活性提高的主要原因.%Low-temperature oxidation of dimethyl ether (DME) to methyl formate (MF) with high selectivity was realized in a continuous flow fixed-bed reactor over the multifunctional MoO3-SnO2 catalysts designed and prepared intentionally. The effect of the preparation methods including mechanical mixing, co-precipitation and co-precipitation-impregnation on the catalyst activity was investigated. The results showed that the selectivity to MF reaches 94.1% at 160℃ over the catalyst prepared by co-precipitation-impregnation, with DME conversion of 33.9% and absence of COx in the products. The results of NH3-TPD, CO2-TPD and H2-TPR characterizations indicated that the catalysts prepared by various methods are also obviously different in the surface acidic, alkaline and redox properties. The results of Raman, XRD and TEM revealed that MoO3 structure and particle sizes have a significant influence on the catalyst activity; small particle size and oligomeric MoO3 may be responsible for the high activity of the MoO3-SnO2 catalysts from co-precipitation-impregnation in the selective oxidation of DME to MF

  8. Dimethyl Ether Synthesis from CO2 Hydrogenation over CuO-TiO2-ZrO2/HZSM-5 Catalysts%CuO-TiO2-ZrO2/HZSM-5催化CO2加氢制二甲醚

    Institute of Scientific and Technical Information of China (English)

    王嵩; 毛东森; 郭晓明; 卢冠忠

    2011-01-01

    A series of CuO-TiO2-ZrO2 mixed oxides with different CuO mass fractions (50%-80%) were prepared by co-precipitation and characterized by X-ray diffraction (XRD), N2 physisorption, temperature-programmed reduction of hydrogen (H2-TPR), temperature-programmed desorption of carbon dioxide (CO2-TPD) and hydrogen (H2-TPD), and reactive N2O adsorption techniques. The prepared CuO-TiO2-ZrO2 samples were mixed physically with HZSM-5 zeolite to synthesize dimethyl ether (DME) from CO2 hydrogenation in a fixed bed reactor at 250 °C, 3.0 Mpa, gas hourly space velocity (GHSV) of 1500 mL-g1-h~\\ and volume ratio of 2.8 for H2 to CO2. We found that the conversion of CO2 increased with an increase in CuO content, reached a maximum at a CuO content of 70% and then decreased. The selectivity of DME increased with an increase in CuO content initially and remained essentially constant when the CuO content was 270%. Thus, the yield of DME reached a maximum of 13.2% at 70% CuO content. The productivity of the oxygenated compounds (including methanol and DME) on the CuO-TiO2-ZrO2/HZSM-5 catalysts is closely related to the metallic copper surface area.%采用共沉淀法制备了一系列CuO含量不同(质量分数:50%-80%)的CuO-TiO2-ZrO2复合氧化物,并利用X射线衍射(XRD)、氮吸附(BET)、程序升温还原(H2-TPR)、程序升温脱附(H2/CO2-TPD)和氧化亚氮(N2O)反应吸附等多种方法对其进行了表征.以所制备的CuO-TiO2-ZrO2为甲醇合成活性组分与HZSM-5分子筛进行机械混合制成双功能催化剂CuO-TiO2-ZrO2/HZSM-5,在微型固定床流动反应器中,于250℃、3.0 MPa、H2/CO2(体积比2.8)以及空速1500 mL·g-1·h-1的条件下,对其催化CO2加氢直接合成二甲醚(DME)的性能进行了评价.结果表明:随着CuO-TiO2-ZrO2中CuO含量的增加,CO2的转化率先逐渐增大,至70%时达到最大,之后反而降低.DME的选择性随着催化剂中CuO含量的增加而增加,至≥70%时基本不变,故当CuO含量为70

  9. Effect of Steam Treatment on Catalytic Performance of HZSM-5 Zeolite for the Synthesis of Dimethyl Ether%水蒸气处理对HZSM-5分子筛催化合成二甲醚反应性能的影响

    Institute of Scientific and Technical Information of China (English)

    毛东森; 夏建超

    2011-01-01

    A series of HZSM-5 zeolites were prepared by steam treatment at different temperatures, and their catalytic performances for methanol dehydration were investigated. Moreover, the prepared HZSM-5 zeolites were physically mixed with a methanol synthesis component (CuO-ZnO-Al2O3) to form hybrid catalysts, and their catalytic performances for the direct synthesis of dimethyl ether (DME) from syngas were studied. The results indicated that the selectivity for DME in the methanol dehydration increased with the increase of steam treatment temperature of HZSM-5 due to the decrease of the acidity in HZSM-5 zeolites. In the direct synthesis of DME from syngas process over the hybrid catalysts with the HZSM-5 steam treated at proper temperature (500℃), the selectivity for undesired CO2 decreased, so the selectivity for DME was enhanced significantly, while with the HZSM-5 steam treated at 600 ℃ , both the CO conversion and DME selectivity were decreased remarkably. No difference in the catalytic performance of the hybrid catalysts was observed with the ammonia treatment and steam treatment of HZSM-5 zeolite.%采用不同水蒸气处理温度制备了一系列HZSM-5分子筛,考察了其催化甲醇脱水反应的性能,并以其为甲醇脱水活性组分与铜基甲醇合成活性组分(Cu-ZnO-Al2O3)组成双功能催化剂,考察了其对合成气直接制二甲醚反应的催化性能.结果表明,随着水蒸气处理温度的提高,HZSM-5分子筛的酸性逐渐减弱,从而使甲醇脱水反应的二甲醚选择性逐渐增大.对于催化合成气直接制二甲醚反应,当HZSM-5分子筛在适当温度(500℃)下进行处理时,可使反应产物中CO2副产物的选择性明显下降,目的产物二甲醚的选择性显著提高.当处理温度过高(600℃)时,CO的转化率和二甲醚的选择性均明显降低.相同温度下的水蒸气和氨水蒸气处理对Cu-ZnO-Al2O3 /HZSM-5双功能催化剂催化合成气直接制二甲醚反应的性能几乎无影响.

  10. ELECTROCHEMICAL POLYMERIZATION OF 5-CYANOINDOLE IN MIXED ELECTROLYTES OF BORON TRIFLUORIDE DIETHYL ETHERATE AND DIETHYL ETHER

    Institute of Scientific and Technical Information of China (English)

    Jing-kun Xu; Wei-qiang Zhou; Jian Hou; Shou-zhi Pu; Jing-wu Wang; Liu-shui Yan

    2006-01-01

    High quality poly(5-cyanoindole) (P5CI) films were electrosynthesized by direct anodic oxidation of 5-cyanoindole on stainless steel sheet in the mixed electrolytes of boron trifluoride diethyl etherate (BFEE) and diethyl ether (EE) (by volume 1:1) + 0.05 mol L-1 Bu4NBF4. The film formed can be peeled off the electrode into freestanding films. The addition of EE into BFEE can improve the solubility of monomer. P5CI films obtained from this medium showed excellent electrochemical behavior with conductivity of 10-2 Scm-1. Structural studies showed that the polymerization of 5-cyanoindole occurred at the 2,3 position. As-formed P5CI films were thoroughly soluble in strong polar organic solvent dimethyl sulfoxide (DMSO) while partly soluble in tetrahydrofuran (THF) or acetone. Fluorescence spectral studies indicated that P5CI was a good blue-light emitter.

  11. Spontaneous Generation of Chirality in Simple Diaryl Ethers.

    Science.gov (United States)

    Lennartson, Anders; Hedström, Anna; Håkansson, Mikael

    2015-07-01

    We studied the spontaneous formation of chiral crystals of four diaryl ethers, 3-phenoxybenzaldehyde, 1; 1,3-dimethyl-2-phenoxybenzene, 2; di(4-aminophenyl) ether, 3; and di(p-tolyl) ether, 4. Compounds 1, 3, and 4 form conformationally chiral molecules in the solid state, while the chirality of 2 arises from the formation of supramolecular helices. Compound 1 is a liquid at ambient temperature, but 2-4 are crystalline, and solid-state CD-spectroscopy showed that they could be obtained as optically active bulk samples. It should be noted that the optical activity arise upon crystallization, and no optically active precursors were used. Indeed, even commercial samples of 3 and 4 were found to be optically active, giving evidence for the ease at which total spontaneous resolution may occur in certain systems.

  12. A Convenient Method for Synthesis of Novel Cyclic Ethers (1R, 2R,3R, 5S, 7S, 9R, 12R)-3-(t-Butyldimethylsilyl)oxy-7-methoxymethyloxy-2, 10-dimethyl-12-oxatricyclo [7.2.1.05,12] dodecane

    Institute of Scientific and Technical Information of China (English)

    Jie YAN; Min ZHU

    2005-01-01

    Novel cyclic esters (1R, 2R, 3R, 5S, 7S, 9R, 12R)-3-(t-butyldimethylsilyl)oxy-7-methoxymethyloxy-2, 10-dimethyl-12-oxatricyclo [7.2.1.05,12] dodecane were prepared when their precursor 1 was treated with SOCl2/pyridine. A plausible mechanism was hypothesized.

  13. 微波辐射下耐硫型Pd催化剂的可控制备及在一步法合成二甲醚中的应用%Controllable preparation of sulfur-tolerant Pd catalysts under microwave irradiation and application of these catalystsin one-step synthesis of dimethyl ether

    Institute of Scientific and Technical Information of China (English)

    褚睿智

    2012-01-01

    .Statistical test shows the data calculated by the mechanism models are consistent with the experiments,so these modelsare reliable.%针对合成气一步法制取二甲醚(Syngas to Dimethyl ether,STD)工艺的研究现状,采用微波技术开发了具有较好耐硫效果的Pd系二甲醚合成催化剂,具体从以下3方面进行了研究开发:首先,进行了Pd系STD反应催化剂制备研究。分别以γ-Al2O3、HZSM-5和Al-MCM-41为载体,采用浸渍法制备了3个系列负载型Pd金属催化剂,通过调控焙烧条件、Pd负载量、助剂类型和复合方式及助剂添加量等实现了对催化剂表面的物相及吸附特性、还原特性、表面酸性等性能的控制,探讨了催化剂STD反应活性与样品本身所固有特性的关系。其次,进行了Pd系催化剂耐硫机理研究。以H2S和噻吩为探针毒物研究硫中毒实验和再生实验后Pd催化剂用于STD反应性能,考察了催化剂载体和助剂类型对Pd催化剂耐硫性能的影响,运用多种表征手段对催化剂的物性结构和反应物化学结构进行表征,分别揭示了Pd金属表面和酸中心上的硫化物吸附形态和吸附特点;利用GC-MS分析确定有机硫和无机硫毒物在CeO2-CaO-Pd/HZSM-5催化剂表面的吸附位置,并推测出其表面的硫化物转化机理。最后,对CeO2-CaO-Pd/HZSM-5催化剂的STD反应动力学进行了研究。选取STD反应活性和耐硫性能优异的CeO2-CaO-Pd/HZSM-5催化剂进行STD反应工艺条件研究,确定了优化工艺条件;在此基础上,建立CeO2-CaO-Pd/HZSM-5双功能催化剂颗粒的动力学方程,统计检验显示该模型可靠,模型计算值与实验值吻合良好。

  14. Vinyl ether silicones

    Energy Technology Data Exchange (ETDEWEB)

    Herzig, C.; Dauth, J.; Deubzer, B.; Weis, J. [Wacker-Chemie GmbH, Burghausen (Germany)

    1995-12-01

    Siloxanes with vinyl ether groups are prepared by hydrosilylation reaction of dihydrosiloxanes with divinyl ethers in excess. Different stoichiometry, produces linear copolymers of different viscosities and double bond concentrations always with an active vinyl ether group at each chain end. Polymerisations triggered by UV light were done with mixtures of these compounds and a series of onium salts. Very fast cure is observed even with low doses at 290 nm. V.E. silicones are found to cure essentially quantitative. The comparison with other highly reactive cationic monomers revealed that compounds are among the fastest curing prepolymers in cationic chemistry.

  15. O-methylation of natural phenolic compounds based on green chemistry using dimethyl carbonate

    Science.gov (United States)

    Prakoso, N. I.; Pangestu, P. H.; Wahyuningsih, T. D.

    2016-02-01

    The alkyl aryl ether compounds, of which methyl eugenol and veratraldehyde are the simplest intermediates can be synthesized by reacting eugenol and vanillin with the green reagent dimethyl carbonate (DMC). The reaction was carried out under mild of temperature and pressure. Excellent yields and selective products were obtained (95-96%) after a few hours. In the end of the reaction, the catalysts (base and Phase Transfer Catalyst) can be recovered and regenerated.

  16. Natural 4-Hydroxy-2,5-dimethyl-3(2H-furanone (Furaneol®

    Directory of Open Access Journals (Sweden)

    Wilfried Schwab

    2013-06-01

    Full Text Available 4-Hydroxy-2,5-dimethyl-3(2H-furanone (HDMF, furaneol® and its methyl ether 2,5-dimethyl-4-methoxy-3(2H-furanone (DMMF are import aroma chemicals and are considered key flavor compounds in many fruit. Due to their attractive sensory properties they are highly appreciated by the food industry. In fruits 2,5-dimethyl-3(2H-furanones are synthesized by a series of enzymatic steps whereas HDMF is also a product of the Maillard reaction. Numerous methods for the synthetic preparation of these compounds have been published and are applied by industry, but for the development of a biotechnological process the knowledge and availability of biosynthetic enzymes are required. During the last years substantial progress has been made in the elucidation of the biological pathway leading to HDMF and DMMF. This review summarizes the latest advances in this field.

  17. STUDY ON THE SYNTHESIS AND PROPERTIES OF POLY(ESTER-IMIDE-ETHER) MULTIBLOCK COPOLYMERS

    Institute of Scientific and Technical Information of China (English)

    Zu-yao Shan; Zhen-yi Li

    2000-01-01

    A new class of poly(ester-imide-ether) multiblock copolymers was synthesized by transes-terification and melt copolymerization of dimethyl terephthalate (DMT) and N-(4-carbomethoxyphenyl)-4-(carbomethoxy)-phthalimide with ethylene glycol (EG) and polytetramethylene glycol (PTMG). The structure of the above copolymers was characterized by 1H-NMR and IR spectroscopy. Some properties of the coplymers were also examined. It was found that their mechanical properties and heat stability, compared with poly(ether-ester) copolymers, were obviously improved.

  18. Methanol and 2-methyl-1-propanol (isobutanol) coupling to ethers and dehydration over Nafion H: Selectivity, kinetics, and mechanism

    Energy Technology Data Exchange (ETDEWEB)

    Nunan, J.G.; Klier, K.; Herman, R.G. (Lehigh Univ., Bethlehem, PA (United States))

    1993-02-01

    The dehydration of a mixture of methanol and isobutanol has been studied over the sulfonic acid Nafion H catalyst. Dehydration products consisted of dimethyl ether (DME), di-isobutyl ether (DIBE), methyl-isobutyl ether (MIBE), butenes, octenes, and traces of methyl-tertiarybutyl ether (MTBE). At low temperatures and high alcohol pressures (P [ge] 150 kPa), the dehydration product slate was dominated by ether formation with selectivity within the ethers significantly in favor of the mixed ether, MIBE. The rates of ether and butene formation as a function of alcohol pressure could be described by Langmuir-Hinshelwood kinetics in which competitive adsorption of the two alcohols on the surface -SO[sub 3]H sites was the dominant feature. The kinetics of isobutanol dehydration to isobutene were consistent with a dual-site mechanism involving the cooperative action of a free surface -SO[sub 3]H site and an adjacent adsorbed alcohol molecule. Dehydration to ethers was consistent with the reaction of two adsorbed alcohols, also by a dual-site mechanism. As a consequence, dehydration to symmetric ethers showed saturation-type kinetics as a function of alcohol pressure, while the rate of isobutene formation went through a distinct maximum. Due to the competitive adsorption of methanol and isobutanol, the mixed ether MIBE was formed at a maximum rate with an optimum ratio of partial pressures of the two alcohols. The high selectivity to MIBE was explained by stronger adsorption of isobutanol on the catalyst surface as compared to methanol. The absence of MTBE and the predominance of products such as MIBE and 2,5-dimethylhexene suggests that dehydration to give free carbenium ions that subsequently rearrange to the more stable tertiary intermediate was not occurring. It was proposed that the alcohols react with the -SO[sub 3]H groups to give oxonium ions or esters. These intermediates couple to give the product ethers or octenes. 24 refs., 13 figs., 1 tab.

  19. Functionalization of oxidized single-walled carbon nanotubes with 4-benzo-9-crown-3 ether

    Indian Academy of Sciences (India)

    Ardeshir Khazaei; Maryam Kiani Borazjani; Khadijeh Mansouri Moradian

    2012-09-01

    Functionalization of oxidized single-walled carbon nanotubes (SWCNTs) by a zwitterionic interaction (COO−NH$^{+}_{3}$) between protonated amine on crown ether and an oxyanion from a carboxylic acid group on SWCNT has been described. This ionic interaction has led to a considerable increase in the solubility of SWCNTs in both organic and aqueous solvents such as ethanol, dimethyl sulphoxide, dimethylformamide, and H2O. The highest solubility was attained in DMF and DMSO. The ionic bonded 4-benzo-9-crown-3 ether allowed the hosting of Li+. The ionic bond of crown ether (4-(benzo-9-crown-3)) to SWCNT was identified and confirmed by infrared spectroscopy, transmission electron-microscopy, atomic force microscopy and thermogravimetric analysis methods.

  20. Solvent-Induced Crystallization of Poly(ether ether ketone)

    OpenAIRE

    McPeak, Jennifer Lynne

    1999-01-01

    The purpose of this study was learn how the diffusion, swelling, and crystallization processes are coupled during solvent-induced crystallization of poly(ether ether ketone) (PEEK). Unoriented amorphous PEEK films were immersed in aprotic organic liquids at ambient temperature and bulk properties or characteristics were monitored as a function of immersion time. The sorption behavior, Tg and Tm° suppression, crystallinity, and dynamic mechanical response were correlated as a function of sol...

  1. Trans-ethyl methyl ether in space - A new look at a complex molecule in selected hot core regions

    CERN Document Server

    Fuchs, G W; Giesen, T F; Wyrowski, F

    2005-01-01

    An extensive search for the complex molecule trans-ethyl methyl ether towards several hot core regions has been performed. Using the IRAM 30m telescope and the SEST 15m we looked at several frequencies where trans-ethyl methyl ether has strong transitions, as well as lines which are particularly sensitive to the physical conditions in which the molecule can be found. We included G34.26, NGC6334(I), Orion KL, and W51e2 which have previously been proven to have a rich chemistry of complex molecules. Our observations cannot confirm the tentative Orion KL detection made by Charnley et al. (2001) within their stated column density limits, but we confirm the existence of the trans-ethyl methyl ether towards W51e2 with a column density of 2x10^14 cm-2. The dimethyl ether/methanol ratio of 0.6 as well as the newly found ethyl methyl ether/ethanol ratio of 0.13 indicate relative high abundances of ethers toward W51e2. Furthermore, the observation of ethyl methyl ether also confirms the importance of ethanol as a grain...

  2. Glyceryl guaiacol ether – review

    OpenAIRE

    Massone, Flávio; Universidade Estadual Paulista; Luna, Stélio Pacca Loureiro; Universidade Estadual Paulista; Castro, Gladys Bastos; Universidade Estadual Paulista

    1996-01-01

    The history, physical and chemical properties, pharmacodynamics, pharmacokinetics, adverse effects, toxicity, clinical use in wild and domestic species and drug interactions with glyceryl guaiacol ether, an a-glyceryt ether, is presented. Guaiphenesin produces muscle relaxation without affecting diaphragmatic function. Besides muscle relaxation, the drug produces hypocholesterolemia, hypouricemia and has antitussive and expectorant actions, among others. It is a safe agent, but can produce th...

  3. Rearrangements of Cycloalkenyl Aryl Ethers

    Directory of Open Access Journals (Sweden)

    Mercedesz Törincsi

    2016-04-01

    Full Text Available Rearrangement reactions of cycloalkenyl phenol and naphthyl ethers and the acid-catalyzed cyclization of the resulting product were investigated. Claisen rearrangement afforded 2-substituted phenol and naphthol derivatives. Combined Claisen and Cope rearrangement resulted in the formation of 4-substituted phenol and naphthol derivatives. In the case of cycloocthylphenyl ether the consecutive Claisen and Cope rearrangements were followed by an alkyl migration. The mechanism of this novel rearrangement reaction is also discussed.

  4. Ether: Bitcoin's competitor or ally?

    OpenAIRE

    Bouoiyour, Jamal; Selmi, Refk

    2017-01-01

    Although Bitcoin has long been dominant in the crypto scene, it is certainly not alone. Ether is another cryptocurrency related project that has attracted an intensive attention because of its additional features. This study seeks to test whether these cryptocurrencies differ in terms of their volatile and speculative behaviors, hedge, safe haven and risk diversification properties. Using different econometric techniques, we show that a) Bitcoin and Ether are volatile and relatively more resp...

  5. Application of density-functional theory to studying methylation with dimethyl carbonate and dimethyl sulfate

    Institute of Scientific and Technical Information of China (English)

    ZHANG Ding-lin; WEI Xi-wen; WANG Xiang-zhi

    2007-01-01

    The activities of dimethyl carbonate and dimethyl sulfate as a methylation reagent were studied by density- functional theory (DFT). B3LYP/6-31G(d, p) methods were used to optimize the structures of dimethyl carbonate and dimethyl sulfate and calculate theirs charge densities. Dimethyl sulfate is easier than dimethyl carbonate to react with a nucleophilic reagent. In dimethyl sulfate, the alkoxy carbons are the only reactive atomic nucleus because of steric hindrance. A nucleophilic reagent is more likely to react with carbonyl carbons than alkoxy carbons of dimethyl carbonate; in the presence of a Lewis acid, the phenyl nucleophilic reagent reacts with the Lewis acid first. Lewis acid increases the negative charge density of a nucleophilic reagent in polar solvent, and also incurs an accretion of steric hindrance. Polar solvent avails to ionize dimethyl carbonate and thus enables the reaction of methylation. The frequencies of transition state calculated by Gaussion 03 confirm the inferred reaction mechanism. The harvest rates of 4-methoxyphenol in the experiments of methylation reactions of hydroquinone with respectively dimethyl carbonate and dimethyl sulfate support the foregoing theortical conclusions.

  6. Design and Synthesis of (2-(5-Chloro-2,2-dimethyl-2,3-dihydrobenzofuran-7-yl)cyclopropyl)methanamine as a Selective Serotonin 2C Agonist.

    Science.gov (United States)

    Cheng, Jianjun; Giguere, Patrick M; Lv, Wei; Roth, Bryan L; Kozikowski, Alan P

    2015-06-03

    A conformationally restricted analog of a selective cyclopropane-bearing serotonin 2C agonist was designed and synthesized. A 2,2-dimethyl-2,3-dihydrobenzofuran scaffold was investigated as a constrained variant of a biologically active isopropyl phenyl ether. Construction of the required dimethyl-2,3-dihydrobenzofuran intermediate began using a procedure that relied on a microwave-assisted alkylation reaction. The synthesis of the designed compound as its HCl salt is reported in a total of 12 steps and 17% overall yield. Biological evaluation revealed the constrained analog to be a selective serotonin 2C agonist with modest potency.

  7. 21 CFR 524.660b - Dimethyl sulfoxide gel.

    Science.gov (United States)

    2010-04-01

    ... 21 Food and Drugs 6 2010-04-01 2010-04-01 false Dimethyl sulfoxide gel. 524.660b Section 524.660b... Dimethyl sulfoxide gel. (a) Specifications. Dimethyl sulfoxide gel, veterinary contains 90 percent dimethyl sulfoxide in an aqueous gel. (b) Sponsor. See No. 000856 in § 510.600(c) of this chapter. (c) Conditions...

  8. Luminescent Lariat Aza-Crown Ether

    Directory of Open Access Journals (Sweden)

    Burkhard König

    2010-03-01

    Full Text Available Lariat ethers are interesting recognition motifs in supramolecular chemistry. The synthesis of a luminescent lariat ether with triglycol chain by azide–alkyne (Huisgen cycloaddition is presented.

  9. Exogenous ether lipids predominantly target mitochondria.

    Directory of Open Access Journals (Sweden)

    Lars Kuerschner

    Full Text Available Ether lipids are ubiquitous constituents of cellular membranes with no discrete cell biological function assigned yet. Using fluorescent polyene-ether lipids we analyzed their intracellular distribution in living cells by microscopy. Mitochondria and the endoplasmic reticulum accumulated high amounts of ether-phosphatidylcholine and ether-phosphatidylethanolamine. Both lipids were specifically labeled using the corresponding lyso-ether lipids, which we established as supreme precursors for lipid tagging. Polyfosine, a fluorescent analogue of the anti-neoplastic ether lipid edelfosine, accumulated to mitochondria and induced morphological changes and cellular apoptosis. These data indicate that edelfosine could exert its pro-apoptotic power by targeting and damaging mitochondria and thereby inducing cellular apoptosis. In general, this study implies an important role of mitochondria in ether lipid metabolism and intracellular ether lipid trafficking.

  10. Toxicity of dimethyl sulfoxide (DMSO) to fish

    National Research Council Canada - National Science Library

    Willford, W.A

    1967-01-01

    Toxicities of dimethyl sulfoxide (DMSO) to rainbow trout, brook trout, lake trout, carp, black bullhead, channel catfish, green sunfish, bluegill, and yellow perch were determined in 24-, 48-, and 96-hour static bioassays at 12 C...

  11. Removal of methanethiol, dimethyl sulfide, dimethyl disulfide, and hydrogen sulfide from contaminated air by Thiobacillus thioparus TK-m.

    OpenAIRE

    Kanagawa, T; Mikami, E.

    1989-01-01

    Methanethiol, dimethyl sulfide, dimethyl disulfide, and hydrogen sulfide were efficiently removed from contaminated air by Thiobacillus thioparus TK-m and oxidized to sulfate stoichiometrically. More than 99.99% of dimethyl sulfide was removed when the load was less than 4.0 g of dimethyl sulfide per g (dry cell weight) per day.

  12. Solubilities of CO2 in some glycol ethers under high pressure by experimental determination and correlation☆

    Institute of Scientific and Technical Information of China (English)

    Wei Wang; Zhi Yun; Zhigang Tang; Xia Gui

    2016-01-01

    The binary vapor–liquid equilibrium data of CO2 in diethylene glycol (monomethyl, monoethyl, monobutyl, di-methyl, diethyl, dibutyl) ether were determined from 288.15 to 318.15 K at pressure up to 6 MPa based on the constant-volume method. It was found by contrast that the ether group in solvents can promote the CO2 absorp-tion, but the hydroxyl group will inhibit the CO2 absorption. Furthermore, the solubilities of CO2 showed an up-ward trend with the increasing molecular lengths of absorbents. The experimental data were also correlated with a modified Patel–Teja equation of state (PT EOS) combined with the traditional van der Waals one-fluid mixing rules and the results showed a satisfactory agreement between the model and the experimental data.

  13. Catalytic Consequences of Acid Strength in the Conversion of Methanol to Dimethyl Ether

    Energy Technology Data Exchange (ETDEWEB)

    Carr, Robert T.; Neurock, Matthew; Iglesia, Enrique

    2011-02-14

    The effects of acid identity on CH{sub 3}OH dehydration are examined here using density functional theory (DFT) estimates of acid strength (as deprotonation energies, DPE) and reaction energies, combined with rate data on Keggin polyoxometalate (POM) clusters and zeolite H-BEA. Measured first-order (k{sub mono}) and zero-order (k{sub dimer}) CH3OH dehydration rate constants depend exponentially on DPE for POM clusters; the value of k{sub mono} depends more strongly on DPE than k{sub dimer} does. The chemical significance of these rate parameters and the basis for their dependences on acid strength were established by using DFT to estimate the energies of intermediates and transition states involved in elementary steps that are consistent with measured rate equations. We conclude from this treatment that CH{sub 3}OH dehydration proceeds via direct reactions of co-adsorbed CH{sub 3}OH molecules for relevant solid acids and reaction conditions. Methyl cations formed at ion-pair transition states in these direct routes are solvated by H{sub 2}O and CH{sub 3}OH more effectively than those in alternate sequential routes involving methoxide formation and subsequent reaction with CH{sub 3}OH. The stability of ion-pairs, prevalent as intermediates and transition states on solid acids, depends sensitively on DPE because of concomitant correlations between the stability of the conjugate anionic cluster and DPE. The chemical interpretation of k{sub mono} and k{sub dimer} from mechanism-based rate equations, together with thermochemical cycles of their respective transition state formations, show that similar charge distributions in the intermediate and transition state involved in k{sub dimer} cause its weaker dependence on DPE. Values of k{sub mono} involve uncharged reactants and the same ion-pair transition state as k{sub dimer}; these species sense acid strength differently and cause the larger effects of DPE on k{sub mono}. Confinement effects in H-BEA affect the value of k{sub mono} because the different sizes and number of molecules in reactants and transition states selectively stabilize the latter; however, they do not influence k{sub dimer}, for which reactants and transition states of similar size sense spatial constraints to the same extent. This combination of theory and experiment for solid acids of known structure sheds considerable light on the relative contributions from solvation, electrostatic and van der Waals interactions in stabilizing cationic transition states and provides predictive insights into the relative contributions of parallel routes based on the size and charge distributions of their relevant intermediates and transition states. These findings also demonstrate how the consequences of acid strength on measured turnover rates depend on reaction conditions and their concomitant changes in the chemical significance of the rate parameters measured. Moreover, the complementary use of experiment and theory in resolving mechanistic controversies has given predictive guidance about how rate and equilibrium constants, often inextricably combined as measured rate parameters, individually depend on acid strength based on the magnitude and spatial distributions of charges in reactants, products and transition states involved in relevant elementary steps. The unique relations between k{sub mono}, k{sub dimer} and DPE developed here for CH{sub 3}OH dehydration can be applied in practice to assess the acid strength of any solid acid, many of which have unknown structures, preventing reliable calculations of their DPE by theory.

  14. Lubrication and wear in diesel engine injection equipment fuelled by dimethyl ether (DME)

    DEFF Research Database (Denmark)

    Sivebæk, Ion Marius

    2003-01-01

    that jeopardise the high efficiency of the engine and increase the manufacturing costs. DME has a low toxicity and can be made from anything containing carbon including biomass. If DME is produced from cheap natural gas from remote locations, the price of this new fuel could even become lower than that of diesel...... oil. Fueling diesel engines with DME presents two significant problems: The injection equipment can break down due to extensive wear and DME attacks nearly all known elastomers. The latter problem renders dynamic sealing diƣult whereas the first one involves the poor lubrication qualities of DME which...... are the main concerns of the present study. The volatile fuel tribotester (VFTT) was developed, capable of testing material compatibility with DME. This apparatus has the potential of selecting new materials for future DME pumps. Two properties are important for describing these lubrication qualities...

  15. Enthalpy of dilution of poly(propylene glycol) dimethyl ether in trichloromethane

    Science.gov (United States)

    Wohlfarth, Ch.

    This document is part of Subvolume D2 'Polymer Solutions - Physical Properties and their Relations I (Thermodynamic Properties: PVT -Data and miscellaneous Properties of polymer Solutions) of Volume 6 `Polymers' of Landolt-Börnstein - Group VIII `Advanced Materials and Technologies'.

  16. pVT data of poly(propylene glycol) dimethyl ether in trichloromethane

    Science.gov (United States)

    Wohlfarth, Ch.

    This document is part of Subvolume D2 'Polymer Solutions - Physical Properties and their Relations I (Thermodynamic Properties: PVT -Data and miscellaneous Properties of polymer Solutions) of Volume 6 `Polymers' of Landolt-Börnstein - Group VIII `Advanced Materials and Technologies'.

  17. Enthalpy of dilution of poly(ethylene glycol) dimethyl ether in trichloromethane

    Science.gov (United States)

    Wohlfarth, Ch.

    This document is part of Subvolume D2 'Polymer Solutions - Physical Properties and their Relations I (Thermodynamic Properties: PVT -Data and miscellaneous Properties of polymer Solutions) of Volume 6 `Polymers' of Landolt-Börnstein - Group VIII `Advanced Materials and Technologies'.

  18. pVT data of poly(ethylene glycol) dimethyl ether in trichloromethane

    Science.gov (United States)

    Wohlfarth, Ch.

    This document is part of Subvolume D2 'Polymer Solutions - Physical Properties and their Relations I (Thermodynamic Properties: PVT -Data and miscellaneous Properties of polymer Solutions) of Volume 6 `Polymers' of Landolt-Börnstein - Group VIII `Advanced Materials and Technologies'.

  19. Multidimensional modeling of Dimethyl Ether(DME) spray combustion in DI diesel engine

    Institute of Scientific and Technical Information of China (English)

    WEN Hua; LIU Yong-chang; WEI Ming-rui; ZHANG Yu-sheng

    2005-01-01

    In the present study a modified CFD code KIVA3V was used to simulate the spray combustion in a small DI diesel engine fueled with DME. The improved spray models consider more spray phenomena such as cavitation flow in nozzle hole, jet atomization, droplet second breakup and spray wall interaction. Otherwise, a reduced DME reaction mechanism is implemented in the combustion model, and a new turbulent combustion model-Partial Stirred Reactor (PaSR) model is selected to simulate the spray combustion process, the effects of turbulent mixing on the reaction rate are considered. The results of engine modeling based on those models agreed well with the experimental measurements. Study of temperature fields variation and particle traces in the combustion chamber revealed that the engine combustion system originally used for diesel fuel must be optimized for DME.

  20. High-Pressure Autoignition of Binary Blends of Methanol and Dimethyl Ether

    OpenAIRE

    Wang, Hongfu; Weber, Bryan W.; Fang, Ruozhou; Sung, Chih-Jen

    2017-01-01

    Reactivity Controlled Compression Ignition (RCCI) is a new advanced engine concept that uses a dual fuel mode of operation to achieve significant improvements in fuel economy and emissions output. The fuels that are typically used in this mode include a low- and a high-reactivity fuel in varying proportions to control ignition timing. As such, understanding the interaction effects during autoignition of binary fuel blends is critical to optimizing these RCCI engines. In this work, we measure ...

  1. Direct dimethyl-ether (DME) synthesis by spatial patterned catalyst arrangement. A modeling and simulation study

    Energy Technology Data Exchange (ETDEWEB)

    McBride, K.; Turek, T.; Guettel, R. [Clausthal Univ. of Technology (Germany). Inst. of Chemical Process Engineering

    2011-07-01

    The effect of spatially patterned catalyst beds was investigated for direct DME synthesis from synthesis gas as an example. A layered arrangement of methanol synthesis and dehydration catalyst was chosen and studied by numerical simulation under typical operating conditions for single-step DME synthesis. It was revealed that catalyst layers significantly influence the DME productivity. With an increasing number of layers from 2 to 40, an increase in DME productivity was observed approaching the performance of a physical catalyst mixture for an infinite number of layers. The results prove that a physical mixture of methanol synthesis and dehydration catalyst achieves the highest DME productivity under operating conditions chosen in this study. This can be explained by the higher average methanol concentration for the layered catalyst arrangement and thus stronger equilibrium constraints for the methanol synthesis reaction. Essentially, the layered catalyst arrangement is comparable to a cascade model of the two-step process, which is less efficient in terms of DME yield than the single-step process. However, since a significant effect was found, the layered catalyst arrangement could be beneficial for other reaction systems. (orig.)

  2. Lubrication and wear in diesel engine injection equipment fuelled by dimethyl ether (DME)

    DEFF Research Database (Denmark)

    Sivebæk, Ion Marius

    2003-01-01

    (MD) calculations and practical lubricity tests to clarify the above. Linear alkanes of varying length were used as lubricants in MD calculations and the results revealed that longer alkanes are better lubricants than shorter ones when surfaces are separated by molecular thin films. These results were...... confirmed by MFPRR tests of alkanes. By inspection of the contacts in the MD calculations, it can be concluded that the length of the alkane is the primary property governing the wear amount. The viscosity is a secondary property as it is a function of the length of the molecule. This conclusion...

  3. 75 FR 4288 - Oxirane, 2-Methyl-, Polymer with Oxirane, Dimethyl Ether; Tolerance Exemption

    Science.gov (United States)

    2010-01-27

    ... natural aquatic environment. 2. The polymer does contain as an integral part of its composition the atomic... composition, except as impurities, any element other than those listed in 40 CFR 723.250(d)(2)(ii). 4. The... recordkeeping requirements. Dated: January 19, 2010. Lois Rossi, Director, Registration Division, Office...

  4. Dimethyl Ether (DME) - Development and Test of the New Volatile Fuel Tribo-Tester VFTT

    DEFF Research Database (Denmark)

    Sivebæk, Ion Marius; Sorenson, Spencer C; Moeller, P.

    2002-01-01

    thoroughly investigated as DME is commonly used as an aerosol propellant. A significant problem when fuelling diesel engines with DME is that the injection equipment breaks down rapidly due to extensive wear. Two main parameters are the causes for these insufficient lubrication qualities of DME...

  5. Autothermal reforming of dimethyl ether with CGO-based precious metal catalysts

    Science.gov (United States)

    Choi, Seunghyeon; Bae, Joongmyeon

    2016-03-01

    In this paper, we investigated the DME ATR reaction with different types of precious metal (Pt, Rh, Ru)-supported CGO catalysts. We also evaluated the reaction characteristics of DME ATR reaction by modifying certain reforming conditions, including the temperature, the amount of air and water, and the flow rate. The Ru-added CGO catalyst showed the best performance in DME ATR. The operating condition that produced the greatest effect on conversion efficiency was temperature; however the amounts of steam and air were also important with regard to conversion efficiency and the reaction heat. In case higher GHSV conditions the methane yields are increased. To maximize conversion efficiency with thermal neutral operating conditions, we suggest an SCR of 1.5, OCR of 0.45, over temperature of 700 °C, and a GHSV of less than 20,000/h. Under harsh conditions, such as low temperature and high GHSV, the methane yield increases. Therefore, the high temperature DME ATR reaction seems to consist of two main steps: the DME decomposition to methane and the methane autothermal reforming reaction.

  6. Direct Synthesis of Dimethyl Ether in Microstructured Reactors: The Interactions Between Methanol Synthesis and Methanol Dehydration

    OpenAIRE

    Dadgar, Farbod

    2016-01-01

    The growing concerns about the climate change, energy security and the diminishing oil reserves, stimulate the search for alternative energy sources and non-petroleum-based fuels. Natural gas in the short-term, and biomass in the long-term, have the potential to satisfy an increasing portion of the energy demands and reduce the dependence on carbon-intensive coal and oil. However, exploitation of highly distributed biomass resources and a considerable amount of the natural gas ...

  7. Dimethyl Ether: New Advances in Wear Testing: Theoretical and Experimental Results

    DEFF Research Database (Denmark)

    Sivebæk, Ion Marius; Sorenson, Spencer C; Jakobsen, J.;

    2003-01-01

    ) on the ball. Up to now, all analyses indicated that fuel viscosity influences the wear scar size and fuel performance in full-scale pumps. The wear scar size could then be a result of hydrodynamic lubrication (at least a significant part of it) and not of boundary lubrication as it was the original intention...... viscosity sensibility issue is seriously aggravated for this fuel. Molecular dynamics calculations involving straight alkanes with lengths from 3 to 14 carbon atoms have been performed. The model is based on simple inter-atomic and surface interactions and it simulates an asperity contact between curved...... surfaces with long-range elasticity. This last property has enabled the model to correlate well with experimental results. The outcome of the alkane calculations indicates that the longer ones lubricate better than the shorts ones but not necessarily because of viscosity differences. The reason is more...

  8. STUDIES ON THE OXIDATION AND GRAFT COPOLYMERIZATION OF POLY(ETHER-URETHANE)

    Institute of Scientific and Technical Information of China (English)

    SUN Yanhui; QIU Kunyuan; FENG Xinde

    1983-01-01

    A new method of graft copolymerization of acrylamide (AAM) on poly(ether-urethane) (PEU)which was prepared from poly(tetramethylene ether) glycol (PTMG), 4,4'-diphenylmethane diisocyanate (MDI) and ethylene diamine or butanediol extender was investigated. Hydroperoxide group was first introduced onto the surface of PEU through photo-oxidation in the presence of hydrogen peroxide, then it was reacted with ferrous ion or N,N-dimethyl toluidine (DMT) to initiate AAM graft copolymerization on PEU surface. The graft reaction could be carried out effectively at low temperature. The formation of graft copolymer has been verified by its water absorption % and the scanning electron microscopy photographs. Some model compounds of PEU soft segment and hard segment were synthesized in order to clarify the site of graft reaction. The results of oxidation and graft copolymerization of model compounds showed that this graft copolymerization possesses higher selectivity, and it takes place predominately at the polyether segments, because the ether linkage in soft segment is very sensitive to oxidation and can form hydroperoxide easily. Thus,the grafting site appears to be at a-carbon of the ether linkage.

  9. Poly(ether ester) Ionomers as Water-Soluble Polymers for Material Extrusion Additive Manufacturing Processes.

    Science.gov (United States)

    Pekkanen, Allison M; Zawaski, Callie; Stevenson, André T; Dickerman, Ross; Whittington, Abby R; Williams, Christopher B; Long, Timothy E

    2017-04-12

    Water-soluble polymers as sacrificial supports for additive manufacturing (AM) facilitate complex features in printed objects. Few water-soluble polymers beyond poly(vinyl alcohol) enable material extrusion AM. In this work, charged poly(ether ester)s with tailored rheological and mechanical properties serve as novel materials for extrusion-based AM at low temperatures. Melt transesterification of poly(ethylene glycol) (PEG, 8k) and dimethyl 5-sulfoisophthalate afforded poly(ether ester)s of sufficient molecular weight to impart mechanical integrity. Quantitative ion exchange provided a library of poly(ether ester)s with varying counterions, including both monovalent and divalent cations. Dynamic mechanical and tensile analysis revealed an insignificant difference in mechanical properties for these polymers below the melting temperature, suggesting an insignificant change in final part properties. Rheological analysis, however, revealed the advantageous effect of divalent countercations (Ca(2+), Mg(2+), and Zn(2+)) in the melt state and exhibited an increase in viscosity of two orders of magnitude. Furthermore, time-temperature superposition identified an elevation in modulus, melt viscosity, and flow activation energy, suggesting intramolecular interactions between polymer chains and a higher apparent molecular weight. In particular, extrusion of poly(PEG8k-co-CaSIP) revealed vast opportunities for extrusion AM of well-defined parts. The unique melt rheological properties highlighted these poly(ether ester) ionomers as ideal candidates for low-temperature material extrusion additive manufacturing of water-soluble parts.

  10. Surface Heparinization of Poly(ether ether ketone)

    Institute of Scientific and Technical Information of China (English)

    SUN Hui; CHEN Rui-chao; LIU Shu; XU Guo-zhi

    2012-01-01

    Photo-grafting of hydrophilic monomer and space arms was used to enhance the hydrophilicity of poly(ether ether ketone)(PEEK) with the aim of extending its application to biological fields.PEEK films were surface modified by UV grafting of acrylic acid(AA) to introduce-COOH on PEEK surface.Adipic amine was used as a.space ann to introduce heparin on PEEK surface based on the condensation reaction between -NH2 and -COOH.The modified PEEK(PEEK-COOH,PEEK-NH2 and PEEK-Hep) was characterized by energy-disperse spectroscopy (EDS),X-ray photoelectron spectroscopy(XPS) and water contact angle measurements,which show that heparin was grafted on PEEK surface.The contact angles of modified PEEK films were lower than those of original films,demonstrating a significant improvement of surface hydrophilicity.

  11. ETG举办针对EtherCAT产品提供商的EtherCAT培训

    Institute of Scientific and Technical Information of China (English)

    2011-01-01

    随着EtherCAT技术的成功推广,越来越多的中国最终用户对EtherCAT技术及其应用感兴趣,并就EtherCAT产品的需求反馈给相关厂商。同时,EtherCAT的产品供应商将更多的ETherCAT投放到中国市场。因此,这些厂商感到更多更深入地了解EtherCAT技术及相关情况将有助于他们开发相关市场。于是,EtherCAT技术协会中国代表处适时举办针对EtherCAT产品提供商的EtherCAT培训。

  12. 40 CFR 721.10127 - Alkenyl dimethyl betaine (generic).

    Science.gov (United States)

    2010-07-01

    ... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Alkenyl dimethyl betaine (generic... Specific Chemical Substances § 721.10127 Alkenyl dimethyl betaine (generic). (a) Chemical substance and... dimethyl betaine (PMN P-06-693) is subject to reporting under this section for the significant new...

  13. 21 CFR 172.133 - Dimethyl dicarbonate.

    Science.gov (United States)

    2010-04-01

    ... accordance with 5 U.S.C. 552(a). Copies are available from the Center for Food Safety and Applied Nutrition... Cosmetic Act: (1) The name of the additive “dimethyl dicarbonate.” (2) The intended use of the additive....

  14. Lung injury in dimethyl sulfate poisoning

    Energy Technology Data Exchange (ETDEWEB)

    Ip, M.; Wong, K.L.; Wong, K.F.; So, S.Y.

    1989-02-01

    Two manual laborers were exposed to dimethyl sulfate during work and sustained mucosal injury to the eyes and respiratory tract. In one of them, noncardiogenic pulmonary edema occurred and improved with high-dose methylprednisolone. On follow-up for 10 months, this patient developed persistent productive cough with no evidence of bronchiectasis or bronchial hyperreactivity.

  15. Synthesis and Characterization of Poly(ether amide)s Containing Bisphthalazinone and Ether Linkages

    Institute of Scientific and Technical Information of China (English)

    Cheng LIU; Shou Hai ZHANG; Ming Jing WANG; Qi Zhen LIANG; Xi Gao JIAN

    2005-01-01

    A novel aromatic diacid, 4, 4'-bis[2-(4-carboxyphenyl)phthalazin-1-one-4-yl]-bisphenyl ether Ⅲ, containing bisphthalazinone and ether linkages was prepared from nucleophilic substitution of p-chlorobenzonitrile with the bisphenol-like monomer Ⅰ, followed by alkaline hydrolysis of the intermediate dinitrile Ⅱ. A series of poly(ether amide)s containing bisphthalazinone and ether linkages derived from diacid Ⅲ and aromatic diamines were synthesized by one-step solution condensation polymerization using triphenyl phosphite and pyridine as condensing agents. Moreover, the properties of poly(ether amide)s including thermal stability,solubility and crystallinity were also studied.

  16. 27 CFR 21.108 - Ethyl ether.

    Science.gov (United States)

    2010-04-01

    ... 27 Alcohol, Tobacco Products and Firearms 1 2010-04-01 2010-04-01 false Ethyl ether. 21.108 Section 21.108 Alcohol, Tobacco Products and Firearms ALCOHOL AND TOBACCO TAX AND TRADE BUREAU, DEPARTMENT....108 Ethyl ether. (a) Odor. Characteristic odor. (b) Specific gravity at 15.56 °/15.56 °C. Not...

  17. An expedient synthesis of linden ether.

    Science.gov (United States)

    Serra, Stefano; Cominetti, Alessandra A

    2014-03-01

    We here describe a comprehensive study on the preparation of the intensive flavor 3,9-epoxy-p-mentha-1,4(8)-diene (1). Key steps of the presented synthesis are the selective addition of MeLi to the keto-ester 7, the regioselective cyclization of the obtained triol to give the ethers 4 and 8 and the selective dehydration of ether 4 through the use of POCI3 and pyridine. It is worth noting that the presented synthesis represents the first expedient and reliable entry to ether 1. Being present in linden honey, 1 is also known as linden ether and it has been regarded as a potential marker for the authentication of the linden honey origin. Therefore, ether 1 can be used as a useful reference standard for the analysis of the natural flavors, as we demonstrated by means of its identification in a sample ofunifloral linden honey.

  18. Characteristics of ultrafine particles emitted from adimethyl ether (DME) engine

    Institute of Scientific and Technical Information of China (English)

    2008-01-01

    Measurements of exhaust particle number concentration and size distribution from a dimethyl ether (DME) engine at different engine loads and speeds were carried out by using a two-stage dilution system and an SMPS. The results of the DME engine were compared with those of the original diesel engine. The fuel composition had significant effects on the exhaust particle size distribution, the total exhaust particle number and mass concentrations. Compared with those of the DME engine, the particle mass emissions of the diesel engine increased 5.7-17.7 times. At high engine speed (n=2200 r/min),compared with those of the DME engine, the total particle number emissions of the diesel engine increased 0.75-2.2 times, while the total particle number emissions of the diesel engine decreased by about 50%-80% for middle and high loads at middle engine speed (n=1400 r/min). Compared with those of the DME engine, the total exhaust particle number concentrations in the accumulation mode of the diesel engine increased 4.2-62.6 times and the exhaust particle geometric number mean diameters in the accumulation mode increased by about 10-30 nm. This correlated with higher oxygen level and lack of C-C bonds in DME. A lot of nucleation mode particles were emitted from the DME engine, this correlated with the processes of nucleation and condensation of the volatile and semi-volatile compounds in the exhaust gas.

  19. A new alternative to expandable pedicle screws: Expandable poly-ether-ether-ketone shell.

    Science.gov (United States)

    Demir, Teyfik

    2015-05-01

    Screw pullout is a very common problem in the fixation of sacrum with pedicle screws. The principal cause of this problem is that the cyclic micro motions in the fixation of sacrum are higher than the other regions of the vertebrae that limit the osteo-integration between bone and screw. In addition to that, the bone quality is very poor at sacrum region. This study investigated a possible solution to the pullout problem without the expandable screws' handicaps. Newly designed poly-ether-ether-ketone expandable shell and classical pedicle screws were biomechanically compared. Torsion test, pullout tests, fatigue tests, flexion/extension moment test, axial gripping capacity tests and torsional gripping capacity tests were conducted in accordance with ASTM F543, F1798 and F1717. Standard polyurethane foam and calf vertebrae were used as embedding medium for pullout tests. Classical pedicle screw pullout load on polyurethane foam was 564.8 N compared to the failure load for calf vertebrae's 1264 N. Under the same test conditions, expandable poly-ether-ether-ketone shell system's pullout loads from polyurethane foam and calf vertebrae were 1196.3 and 1890 N, respectively. The pullout values for expandable poly-ether-ether-ketone shell were 33% and 53% higher than classical pedicle screw on polyurethane foam and calf vertebrae, respectively. The expandable poly-ether-ether-ketone shell exhibited endurance on its 90% of yield load. Contrary to poly-ether-ether-ketone shell, classical pedicle screw exhibited endurance on 70% of its yield load. Expandable poly-ether-ether-ketone shell exhibited much higher pullout performance than classical pedicle screw. Fatigue performance of expandable poly-ether-ether-ketone shell is also higher than classical pedicle screw due to damping the micro motion capacity of the poly-ether-ether-ketone. Expandable poly-ether-ether-ketone shell is a safe alternative to all other expandable pedicle screw systems on mechanical perspective

  20. Photopolymerization of Glycerin Triglycidyl Ether Based Systems

    Institute of Scientific and Technical Information of China (English)

    HUANG Biwu; CHEN Yiwang; DENG Qilan

    2008-01-01

    Photopolymerization process of glycerin triglycidyl ether based systems was studied by an FT-IR spectrometer.An increase in the rate of polymerization for glycerin triglycidyl ether was evident when 3,4-epoxycyclohexylmethyl-3',4'-epoxycyclohexanecarboxylate was added to it.Its copolymerization mechanism was confirmed by using DSC analysis.The effect of ethoxylated trimethyol propane triacrylate on the rate of polymerization for glycerin triglycidyl ether was also studied,and the formation of interpenetrating network tightly cross-link was proposed.

  1. A transferable force field to predict phase equilibria and surface tension of ethers and glycol ethers.

    Science.gov (United States)

    Ferrando, Nicolas; Lachet, Véronique; Pérez-Pellitero, Javier; Mackie, Allan D; Malfreyt, Patrice; Boutin, Anne

    2011-09-15

    We propose a new transferable force field to simulate phase equilibrium and interfacial properties of systems involving ethers and glycol ethers. On the basis of the anisotropic united-atom force field, only one new group is introduced: the ether oxygen atom. The optimized Lennard-Jones (LJ) parameters of this atom are identical whatever the molecule simulated (linear ether, branched ether, cyclic ether, aromatic ether, diether, or glycol ether). Accurate predictions are achieved for pure compound saturated properties, critical properties, and surface tensions of the liquid-vapor interface, as well as for pressure-composition binary mixture diagrams. Multifunctional molecules (1,2-dimethoxyethane, 2-methoxyethanol, diethylene glycol) have also been studied using a recently proposed methodology for the calculation of the intramolecular electrostatic energy avoiding the use of additional empirical parameters. This new force field appears transferable for a wide variety of molecules and properties. It is furthermore worth noticing that binary mixtures have been simulated without introducing empirical binary parameters, highlighting also the transferability to mixtures. Hence, this new force field gives future opportunities to simulate complex systems of industrial interest involving molecules with ether functions.

  2. 基于FPGA的EtherCAT从站节点开发%FPGA- based Development of EtherCAT Slave Node

    Institute of Scientific and Technical Information of China (English)

    李昆; 杨建武

    2011-01-01

    随着实时工业以太网技术在工业自动化领域的发展和应用,德国倍福公司推出的EtherCAT技术尤其备受瞩目.EtherCAT技术的核心在于EtherCAT通信机制、EtherCAT主站和EtherCAT从站节点.EtherCAT从站节点通常是采用EtherCAT从站控制芯片和从站控制微处理器来设计实现的,对此提出了一种使用FPGA技术开发实现EtherCAT从站节点功能的方法,并验证了方法的可行性.%With the development and application of the real - time industrial Ethernet technology in industrial automation, EtherCAT technology introduced by Beckhoff is especially well received. The core of EtherCAT technology is the EtherCAT communication mechanisms, EtherCAT Master and EtherCAT Slave Node. EtherCAT slave node is usually designed by using EtherCAT slave controller chip and slave control microprocessor chip to achieve its function, this paper presents a method which is using FPGA technology to develop the EtherCAT slave node, and verifies the feasibility of it.

  3. Vacuum condensates and `ether-drift' experiments

    OpenAIRE

    Consoli, M.; Pagano, A.; Pappalardo, L.

    2003-01-01

    The idea of a `condensed' vacuum state is generally accepted in modern elementary particle physics. We argue that this should motivate a new generation of precise `ether-drift' experiments with present-day technology.

  4. Activity relationships for aromatic crown ethers

    CERN Document Server

    Wilson, M J

    1998-01-01

    This thesis involves an investigation of aromatic crown ethers and a study of their binding constants for alkali metals. The study was motivated by the current needs of the semiconductor industry to improve the scavenging of mobile ions from fabricated circuits. A number of aromatic crown ethers have been sulphonated in an attempt to improve their water solubility and cation binding activity. These materials have been extensively studied and their binding activity determined. In collaboration with a molecular modelling study, the effect of ionisable sulphonate groups on the macrocycles' behaviour has been investigated. The broader issue of the effect of substituents in aromatic crown ethers has also been studied with the preparation of a wide range of substituted crown ethers. The cation binding activity of these materials has been found to bear a simple relationship to the electron withdrawing nature of the aromatic substituents. This relationship can be accurately monitored using electronic charge densities...

  5. Exogenous ether lipids predominantly target mitochondria

    DEFF Research Database (Denmark)

    Kuerschner, Lars; Richter, Doris; Hannibal-Bach, Hans Kristian

    2012-01-01

    Ether lipids are ubiquitous constituents of cellular membranes with no discrete cell biological function assigned yet. Using fluorescent polyene-ether lipids we analyzed their intracellular distribution in living cells by microscopy. Mitochondria and the endoplasmic reticulum accumulated high......, accumulated to mitochondria and induced morphological changes and cellular apoptosis. These data indicate that edelfosine could exert its pro-apoptotic power by targeting and damaging mitochondria and thereby inducing cellular apoptosis. In general, this study implies an important role of mitochondria...

  6. Interactions and Binding Energies of Dimethyl Methylphosphonate and Dimethyl Chlorophosphate with Amorphous Silica

    Science.gov (United States)

    2012-07-10

    and Decomposition of Dimethyl Methylphosphonate on TiO2 . J. Phys. Chem. B 2000, 104, 12292−12298. (13) Polanyi, M.; Wigner, E. Über die Interferenz von...319, 177−184. (18) Palmero, A.; Loffler, D. G. Kinetics of Water Desorption from Pelletized 4A and 5A Zeolites. Thermochim. Acta 1990, 159, 171−176

  7. A method for analysis of dimethyl selenide and dimethyl diselenide by LC-ICP-DRC-MS.

    Science.gov (United States)

    Lunøe, Kristoffer; Skov, Søren; Gabel-Jensen, Charlotte; Stürup, Stefan; Gammelgaard, Bente

    2010-12-01

    The aim of this work was to develop a simple and fast high performance liquid chromatography-inductively coupled argon plasma (ICP) mass spectrometry (MS) method capable of separating and detecting the two volatile selenium species dimethyl selenide (DMeSe) and dimethyl diselenide (DMeDSe) in biological samples. Dimethyl selenide and dimethyl diselenide were separated on a short reversed phase column using an eluent containing 40% methanol and detected by dynamic reaction cell ICP-MS monitoring the (80)Se isotope. The limit of detection was 8 nM for both species (corresponding to 0.6 and 1.3 μg Se/L for DMeDSe and DMeSe, respectively). Both compounds exhibited a linear signal-concentration relationship in the investigated concentration range of 0.1-1 μM with a precision on the determinations better than 3%. The method was applied for analysis of samples from cancer cell lines incubated with methylseleninic acid, selenomethionine, Se-methylselenocysteine, and sodium selenite. DMeDSe were detected in some samples. The method offers a simple and fast analysis of DMeDSe and DMeSe using standard liquid chromatography coupled with ICP-MS equipment and interfacing.

  8. Determination of dimethyl selenide and dimethyl sulphide compounds causing off-flavours in bottled mineral waters.

    Science.gov (United States)

    Guadayol, Marta; Cortina, Montserrat; Guadayol, Josep M; Caixach, Josep

    2016-04-01

    Sales of bottled drinking water have shown a large growth during the last two decades due to the general belief that this kind of water is healthier, its flavour is better and its consumption risk is lower than that of tap water. Due to the previous points, consumers are more demanding with bottled mineral water, especially when dealing with its organoleptic properties, like taste and odour. This work studies the compounds that can generate obnoxious smells, and that consumers have described like swampy, rotten eggs, sulphurous, cooked vegetable or cabbage. Closed loop stripping analysis (CLSA) has been used as a pre-concentration method for the analysis of off-flavour compounds in water followed by identification and quantification by means of GC-MS. Several bottled water with the aforementioned smells showed the presence of volatile dimethyl selenides and dimethyl sulphides, whose concentrations ranged, respectively, from 4 to 20 ng/L and from 1 to 63 ng/L. The low odour threshold concentrations (OTCs) of both organic selenide and sulphide derivatives prove that several objectionable odours in bottled waters arise from them. Microbial loads inherent to water sources, along with some critical conditions in water processing, could contribute to the formation of these compounds. There are few studies about volatile organic compounds in bottled drinking water and, at the best of our knowledge, this is the first study reporting the presence of dimethyl selenides and dimethyl sulphides causing odour problems in bottled waters.

  9. Revisiting optical clearing with dimethyl sulfoxide (DMSO)

    Science.gov (United States)

    Bui, Albert K.; McClure, R. Anthony; Chang, Jennell; Stoianovici, Charles; Hirshburg, Jason; Yeh, Alvin T.; Choi, Bernard

    2009-01-01

    Functional optical characterization of disease progression and response to therapy suffers from loss of spatial resolution and imaging depth due to scattering. Here we report on the ability of dimethyl sulfoxide (DMSO) alone to reduce the optical scattering of skin. We observed a three-fold reduction in the scattering of skin with topical DMSO application. With an in vivo window chamber model, we observed a three-fold increase in light transmittance through the preparation and enhanced visualization of subsurface microvasculature. Collectively, our data demonstrate the potential of DMSO alone to mitigate effects of scattering, which we expect will improve molecular imaging studies. PMID:19226579

  10. Chemical leukoderma induced by dimethyl sulfate*

    Science.gov (United States)

    Gozali, Maya Valeska; Zhang, Jia-an; Yi, Fei; Zhou, Bing-rong; Luo, Dan

    2016-01-01

    Chemical leukoderma occurs due to the toxic effect of a variety of chemical agents. Mechanisms include either destruction or inhibition of melanocytes. We report two male patients (36 and 51 years old) who presented with multiple hypopigmented macules and patches on the neck, wrist, and legs after exposure to dimethyl sulfate in a chemical industry. Physical examination revealed irregular depigmentation macules with sharp edges and clear hyperpigmentation around the lesions. History of repeated exposure to a chemical agent can help the clinical diagnosis of chemical leukoderma. This diagnosis is very important for prognosis and therapeutic management of the disease.

  11. Rotational Investigation of the Adducts of Formic Acid with Alcohols, Ethers and Esters

    Science.gov (United States)

    Evangelisti, Luca; Spada, Lorenzo; Li, Weixing; Caminati, Walther

    2016-06-01

    Mixtures of formic acid with methyl alcohol, with isopropyl alcohol, with tert-butyl alcohol, with dimethylether and with isopropylformiate have been supersonically expanded as pulsed jets. The obtained cool plumes have been analyzed by Fourier transform microwave spectroscopy. It has been possible to assign the rotational spectra of the 1:1 adducts of formic acid with tert-butyl alcohol, with dimethyl ether and with isopropylformiate. The conformational shapes and geometries of these adducts, as well as the topologies of their itermolecular hydrogen bonds will be presented. An explanation is given of the failure of the assignments of the rotational spectra of the adducts of formic acid with methyl alcohol and isopropyl alcohol.

  12. Thin sulfonated poly(ether ether ketone) films for the dehydration of compressed carbon dioxide

    NARCIS (Netherlands)

    Koziara, B.T.

    2015-01-01

    In this thesis, the properties of thin films from highly sulfonated poly(ether ether ketone) (SPEEK) have been investigated within the context of their application as membranes for the dehydration of compressed carbon dioxide. Spectroscopic ellipsometry has been used as the predominant measurement t

  13. Optical anisotropy, molecular orientations, and internal stresses in thin sulfonated poly(ether ether ketone) films

    NARCIS (Netherlands)

    Koziara, Beata; Nijmeijer, Dorothea C.; Benes, Nieck Edwin

    2015-01-01

    The thickness, the refractive index, and the optical anisotropy of thin sulfonated poly(ether ether ketone) films, prepared by spin-coating or solvent deposition, have been investigated with spectroscopic ellipsometry. For not too high polymer concentrations (B5 wt%) and not too low spin speeds

  14. Optical anisotropy, molecular orientations, and internal stresses in thin sulfonated poly(ether ether ketone) films

    NARCIS (Netherlands)

    Koziara, B.T.; Nijmeijer, D.C.; Benes, N.E.

    2015-01-01

    The thickness, the refractive index, and the optical anisotropy of thin sulfonated poly(ether ether ketone) films, prepared by spin-coating or solvent deposition, have been investigated with spectroscopic ellipsometry. For not too high polymer concentrations (B5 wt%) and not too low spin speeds (C20

  15. 21 CFR 73.37 - Astaxanthin dimethyl-disuccinate.

    Science.gov (United States)

    2010-04-01

    ... 21 Food and Drugs 1 2010-04-01 2010-04-01 false Astaxanthin dimethyl-disuccinate. 73.37 Section 73... LISTING OF COLOR ADDITIVES EXEMPT FROM CERTIFICATION Foods § 73.37 Astaxanthin dimethyl-disuccinate. (a) Identity. (1) The color additive astaxanthin dimethyldisuccinate is...

  16. Dimethyl fumarate modulates antioxidant and lipid metabolism in oligodendrocytes

    Directory of Open Access Journals (Sweden)

    He Huang

    2015-08-01

    Full Text Available Oxidative stress contributes to pathology associated with inflammatory brain disorders and therapies that upregulate antioxidant pathways may be neuroprotective in diseases such as multiple sclerosis. Dimethyl fumarate, a small molecule therapeutic for multiple sclerosis, activates cellular antioxidant signaling pathways and may promote myelin preservation. However, it is still unclear what mechanisms may underlie this neuroprotection and whether dimethyl fumarate affects oligodendrocyte responses to oxidative stress. Here, we examine metabolic alterations in oligodendrocytes treated with dimethyl fumarate by using a global metabolomic platform that employs both hydrophilic interaction liquid chromatography–mass spectrometry and shotgun lipidomics. Prolonged treatment of oligodendrocytes with dimethyl fumarate induces changes in citric acid cycle intermediates, glutathione, and lipids, indicating that this compound can directly impact oligodendrocyte metabolism. These metabolic alterations are also associated with protection from oxidant challenge. This study provides insight into the mechanisms by which dimethyl fumarate could preserve myelin integrity in patients with multiple sclerosis.

  17. Energetics and dissociation pathways of dimethyl disulfide and dimethyl diselenide using photoelectron photoion coincidence spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Borkar, Sampada [Department of Chemistry, University of the Pacific, Stockton, CA 95211 (United States); Sztáray, Bálint, E-mail: bsztaray@pacific.edu [Department of Chemistry, University of the Pacific, Stockton, CA 95211 (United States); Bodi, Andras, E-mail: andras.boedi@psi.ch [Molecular Dynamics Group, Paul Scherrer Institut, Villigen 5232 (Switzerland)

    2014-10-15

    Internal energy selected dimethyl disulfide and dimethyl diselenide cations were prepared by vacuum ultraviolet threshold photoionization in Imaging Photoelectron Photoion Coincidence (iPEPICO) spectroscopy experiments. XH-, CH{sub 3}- and CH{sub n}X-loss reactions (n = 2–4, X = S, Se) were observed in both samples with varying branching ratios. SH loss from dimethyl disulfide, DMDS, and SeH loss from dimethyl diselenide were both found to be slow at threshold, and proceed through a tight transition state. By modeling the breakdown diagram and the ion time-of-flight distributions to extract unimolecular dissociation rates to account for kinetic shifts, we obtained a new, significantly revised 0 K SH-loss CH{sub 3}SCH{sub 2}{sup +} appearance energy. At slightly higher energies, CH{sub n}X{sup +} (n = 2–4) fragments are observed, still in the metastable energy range of the parent ion. Later, CH{sub 3}-loss outcompetes the lower energy channels and becomes dominant. At yet higher energies, the CH{sub 3}-loss fragment ion, probably CH{sub 3}X{sub 2}{sup +}, forms CHX{sup +} by H{sub 2}X abstraction. The newly obtained 0 K appearance energies are used in the ion cycle to discuss the heats of formation of CH{sub 3}SCH{sub 2}{sup +}, CH{sub 3}S{sub 2}{sup +}, CH{sub 2}S{sup +}, C{sub 2}H{sub 5}Se{sup +}, and CH{sub 3}Se{sub 2}{sup +}.

  18. EtherCAT协议分析

    Institute of Scientific and Technical Information of China (English)

    杨晓鸿

    2014-01-01

    <正>EtherCAT协议是德国倍福自动化有限公司(Beckhoff Automation GmbH)于2003年提出,并于2005年被定为IEC标准62407;2007年,IEC把EtherCAT协议加到工业现场总线标准61158。一、协议概述为提高通信效率以及实时性,EtherCAT协议的主要思想有两方面。简化协议,协议兼容以太网的MAC层协议,并由纯硬件完成解析,提高处理速度;而其他协议由软件

  19. Preparation of composite poly(ether block amide) membrane for CO2 capture

    Institute of Scientific and Technical Information of China (English)

    Lianjun Wang; Yang Li; Shuguang Li; Pengfei Ji; Chengzhang Jiang

    2014-01-01

    In this study, a poly(ether block amide) (Pebax 1657) composite membrane applied for CO2 capture was prepared by coating Pebax 1657 solution on polyacrylonitrile (PAN) ultrafiltration membrane. Ethanol/water mixture was used as the solvent of Pebax and the effects of ethanol/water mass ratios and Pebax concentration on the permeation properties of composite membrane were studied. To enhance the com-posite membrane permeance, the gutter layer, made from reactive amino silicone crosslinking with polydimethylsiloxane (PDMS), was de-signed. The influence of crosslinking degree of the gutter layer on membrane performance was investigated. As a result, a Pebax/amino-PDMS/PAN multilayer membrane with hexane resistance was developed, showing CO2 permeance of 350 GPU and CO2/N2 selectivity over 50. The blend of polyethylene glycol dimethyl ether (PEG-DME) with Pebax as coating material was studied to further improve the membrane performance. After being combined with PEG-DME additive, CO2 permeance of the final Pebax-PEG-DME/amino-PDMS/PAN composite membrane reached 400 GPU above with CO2/N2 selectivity over 65.

  20. Limonene ethers from tire pyrolysis oil

    Energy Technology Data Exchange (ETDEWEB)

    Stanciulescu, Maria; Ikura, Michio [CANMET Energy Technology Centre, Natural Resources Canada, 1 Haanel Drive, Ottawa, ON (Canada)

    2006-03-01

    Tire pyrolysis oil was produced by EnerVision Inc., Halifax, Canada using the continuous ablative reactor (CAR) system. The tire oil was separated by distillation into several fractions. Naphtha and limonene enriched naphtha were reacted with methanol over different catalysts. Batch experiments were carried out to separate limonene as methyl limonene ethers. Whole tire pyrolysis oil was distilled and the resulting distillates were redistilled to separate the limonene (bp about 176{sup o}C). Vacuum distillation yielded on average 25.5wt% naphtha containing 16.3wt% limonene (average). Redistillation increased the limonene concentration to approximately 32-37wt%. The conversion of limonene (mono-terpene) to limonene ethers (terpenoides) shifted the boiling point of the limonene derivatives out of the naphtha boiling range (IBP -190{sup o}C). This allowed the separation of fragrant limonene ethers from foul smelling naphtha. Alkoxylation reactions were performed mostly using methanol and acidic catalysts. The methyl ether [1-methyl-4-({alpha}-methoxy-isopropyl)-1-cyclohexene] has a boiling point of about 198{sup o}C which is higher than the end boiling point of the naphtha cut. Five heterogeneous catalysts (four zeolites and one ion exchange resin) were tested in a batch reactor. {beta}-Zeolite produced excellent results. The reaction of R-(+)-limonene with methanol in the presence of activated {beta}-zeolite yielded methyl ether, 87.5% at selectivity 89.7% with a maximum of 2h reaction time. Limonene conversion from whole naphtha to ethers was also high. (author)

  1. Rigid-strut-containing crown ethers and [2]catenanes for incorporation into metal-organic frameworks.

    Science.gov (United States)

    Zhao, Yan-Li; Liu, Lihua; Zhang, Wenyu; Sue, Chi-Hau; Li, Qiaowei; Miljanić, Ognjen S; Yaghi, Omar M; Stoddart, J Fraser

    2009-12-14

    To introduce crown ethers into the struts of metal-organic frameworks (MOFs), general approaches have been developed for the syntheses of dicarboxylic acid dibenzo[30]crown-10 (DB30C10DA), dicarboxylic acid di-2,3-naphtho[30]crown-10 (DN30C10DA), dicarboxylic acid bisparaphenylene[34]crown-10 (BPP34C10DA), and dicarboxylic acid 1,5-naphthoparaphenylene[36]crown-10 (NPP36C10DA). These novel crown ethers not only retain the characteristics of their parent crown ethers since they can 1) bind cationic guests and 2) serve as templates for making mechanically interlocked molecules (MIMs), such as catenanes and rotaxanes, but they also present coordination sites to connect with secondary building units (SBUs) in MOFs. The binding behavior of BPP34C10DA with 1,1'-dimethyl-4,4'-bipyridinium bis(hexafluorophosphate) (DMBP2.PF(6)) has been investigated by means of UV/Vis, fluorescence, and NMR spectroscopic techniques. The crystal superstructure of the complex DMBP2.PF(6) subset BPP34C10DA was determined by X-ray crystallography. The NPP36C10DA-based [2]catenane (H(2)NPP36C10DC-CAT4.PF(6)) and the BPP34C10DA-based [2]catenane (H(2)BPP34C10DC-CAT4.PF(6)) were prepared in DMF at room temperature by the template-directed clipping reactions of the planarly chiral NPP36C10DA and BPP34C10DA with 1,1'-[1,4-phenylenebis(methylene)]di-4,4'-bipyridin-1-ium bis(hexafluorophosphate) and 1,4-bis(bromomethyl)benzene, respectively. The crystal structure of the dimethyl ester (BPP34C10DE-CAT4.PF(6)) of the [2]catenane H(2)BPP34C10DC-CAT4.PF(6) was investigated by X-ray crystallography, which revealed racemic R and S isomers with planar chirality present in the crystal in a 1:1 ratio. These crown ether based struts serve as excellent organic ligands to bind with transition metal ions in the construction of MOFs: the crown ethers BPP34C10DA and NPP36C10DA in the presence of Zn(NO(3))(2)4.H(2)O afforded the MOF-1001 and MOF-1002 frameworks, respectively. The crystal structures of MOF-1001 and

  2. Finkelstein Reaction in Functionalized Crown-ether Ionic Liquids

    Institute of Scientific and Technical Information of China (English)

    Xiao Hua WANG; Han Zhi WANG; Hui LIU; Yuan KOU

    2006-01-01

    Functional crown-ether ionic liquids were used as catalytic green solvents of Finkelstein reaction of 1-bromooctane and iodide. The rate and yield of the reaction were obvious improved compared with that using crown ether in water. No free crown ether loss was observed after reaction.

  3. 40 CFR 721.3435 - Butoxy-substituted ether alkane.

    Science.gov (United States)

    2010-07-01

    ... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Butoxy-substituted ether alkane. 721... Substances § 721.3435 Butoxy-substituted ether alkane. (a) Chemical substance and significant new uses subject to reporting. (1) The chemical substance identified generically as butoxy-substituted ether...

  4. 46 CFR 151.50-42 - Ethyl ether.

    Science.gov (United States)

    2010-10-01

    ... 46 Shipping 5 2010-10-01 2010-10-01 false Ethyl ether. 151.50-42 Section 151.50-42 Shipping COAST... LIQUID HAZARDOUS MATERIAL CARGOES Special Requirements § 151.50-42 Ethyl ether. (a)(1) Gravity tanks... liquid. (g) Precautions shall be taken to prevent the contamination of ethyl ether by strong...

  5. Spray characteristics of dimethyl ether (D.M.E.) as on alternative fuel for diesel engine; Daitai diesel nenryo to shite no dimethyl ether (D.M.E.) no funmu tokusei ni kansuru kenkyu

    Energy Technology Data Exchange (ETDEWEB)

    Wakai, K.; Nishida, K.; Yoshizaki, T.; Hiroyasu, H. [Hiroshima University, Hiroshima (Japan)

    1997-10-01

    D.M.E. which was paid attention to as on alternative fuel for a diesel engine, was injected by using Bosch type injection pump and a hole nozzle into a high pressure and high temperature vessel. The spray was observed by using schlieren photography. Spray characteristics, such as, the tip penetration, the cone angle and the volume of the spray were and were compared with a diesel fuel spray. The following thing, and so on were found out as a results. The spray angle of the DME spray of atmosphere pressure Pa=0.1Mpa spreads out large in comparison with the diesel fuel spray, and the way of the change by the pressure is contrary to the case of the diesel fuel spray. 3 refs., 6 figs., 1 tab.

  6. Synthesis of Liquefied Petroleum Gas via Methanol and/or Dimethyl Ether from Natural Gas (Part 3) Investigation of Reaction Variables, Ethene Recycling and Catalyst Regeneration at High Conversion from Methanol and/or Dimethyl Ether to LPG

    National Research Council Canada - National Science Library

    金, 英傑; 浅岡, 佐知夫; 黎, 暁紅; 朝見, 賢二; 藤元, 薫

    2005-01-01

    天然ガスからの燃料合成の潜在的ルートであるメタノールおよび/あるいはジメチルエーテル(DME)の液化石油ガス(LPG)への転化について,H-ZSM-5およびH-FeAlMFI-シリケート触媒上で,高転化率でLPG成分への高選択性が得られる条件,生成エチレンのリサイクル,触媒の活性低下と再生を検討した。...

  7. Orphan enzymes in ether lipid metabolism.

    Science.gov (United States)

    Watschinger, Katrin; Werner, Ernst R

    2013-01-01

    Ether lipids are an emerging class of lipids which have so far not been investigated and understood in every detail. They have important roles as membrane components of e.g. lens, brain and testis, and as mediators such as platelet-activating factor. The metabolic enzymes for biosynthesis and degradation have been investigated to some extent. As most involved enzymes are integral membrane proteins they are tricky to handle in biochemical protocols. The sequence of some ether lipid metabolising enzymes has only recently been reported and other sequences still remain obscure. Defined enzymes without assigned sequence are known as orphan enzymes. One of these enzymes with uncharacterised sequence is plasmanylethanolamine desaturase, a key enzyme for the biosynthesis of one of the most abundant phospholipids in our body, the plasmalogens. This review aims to briefly summarise known functions of ether lipids, give an overview on their metabolism including the most prominent members, platelet-activating factor and the plasmalogens. A special focus is set on the description of orphan enzymes in ether lipid metabolism and on the successful strategies how four previous orphans have recently been assigned a sequence. Only one of these four was characterised by classical protein purification and sequencing, whereas the other three required alternative strategies such as bioinformatic candidate gene selection and recombinant expression or development of an inhibitor and multidimensional metabolic profiling.

  8. POLYBROMINATED DIPHENYL ETHERS IN SOUTHERN MISSISSIPPI CATFISH

    Science.gov (United States)

    Polybrominated diphenyl ethers (PBDEs) are used as flame retardants in a wide variety of consumer products. Concerns surrounding these compounds are primarily due do their ubiquitous presence in the environment as well as in human tissue, such as milk, coupled with evidence indi...

  9. Ether, Luminosity and Galactic Source Counts

    CERN Document Server

    Tomaschitz, R

    1998-01-01

    An interpretation of the cosmological redshift in terms of a cosmic ether is given. We study a Robertson-Walker cosmology in which the ether is phenomenologically defined by a homogeneous and isotropic permeability tensor. The speed of light becomes so a function of cosmic time like in a dielectric medium. However, the cosmic ether is dispersion free, it does not lead to a broadening of spectral lines. Locally, in Euclidean frames, the scale factors of the permeability tensor get absorbed in the fundamental constants. Mass and charge scale with cosmic time, and so do atomic energy levels. This substantially changes the interpretation of the cosmological redshift as a Doppler shift. Photon frequencies are independent of the expansion factor; their time scaling is determined by the permeability tensor. The impact of the ether on the luminosity-distance, on the distance-redshift relation, and on galactic number counts is discussed. The Hubble constant is related to the scale factors of the metric and the permeab...

  10. Biosynthesis of archaeal membrane ether lipids

    NARCIS (Netherlands)

    Jain, Samta; Caforio, Antonella; Driessen, Arnold J. M.

    2014-01-01

    A vital function of the cell membrane in all living organism is to maintain the membrane permeability barrier and fluidity. The composition of the phospholipid bilayer is distinct in archaea when compared to bacteria and eukarya. In archaea, isoprenoid hydrocarbon side chains are linked via an ether

  11. 乙二醇二烷基醚的研究进展%Synthesis Research Progress of Ethylene Glycol Dialkyl Ethers

    Institute of Scientific and Technical Information of China (English)

    于荟; 于清跃; 魏洪宇; 朱音

    2016-01-01

    综述了生产与合成乙二醇二烷基醚的方法,分析了各种方法的优缺点及研究进展,重点介绍了环氧化合物开环与二甲醚的插入反应合成乙二醇二烷基醚的研究进展,认为该方法具有重大应用前景。%The production and syntheses methods of ethylene glycol dialkyl ethers were reviewed. The advantage, disadvantage and the research progress were also analyzed. The methods of the ring opening of ethylene oxide and insertion of dimethyl ether were emphatically introduced. It was considered that this method had important application prospect.

  12. Based Design EtherCAT Slave%基于EtherCAT的从站设计

    Institute of Scientific and Technical Information of China (English)

    文辉

    2015-01-01

    Fieldbus has become an important part of the automatic control technology, through a large number of practical experiments and testing, now widely applied. EtherCAT has good real-time capability to adapt to the small amount of data communications, and affordable, the industrial control has been widely used. However, due to EtherCAT Slave design must use a special chip, leading from the station complex hardware design, commissioning difficulties, increasing costs. In this paper, AM3358 Cortex A8 processor plus Ethernet physical layer transceiver (PHY) program, due to the integrated chip inside AM3358 Industrial communications subsystem (PRU-ICSS) EtherCAT protocol can be achieved, so long as the external PHY can become EtherCAT Slave ..%现场总线已经成为自动化控制技术重要组成部分,通过大量的实践实验与测试,如今已经获得广泛的应用。EtherCAT具有良好的实时能力,适应小数据量通信,并且价格经济,在工业控制上得到广泛的应用。但由于EtherCAT从站设计必须使用专门的芯片,导致从站的硬件设计复杂、调试困难、成本增加。文章采用AM3358 Cortex A8处理器外加以太网物理层收发器(PHY)的方案,由于AM3358片内集成工业用通信子系统(PRU-ICSS)可以实现EtherCAT协议,因此只要外加PHY就可以成为EtherCAT从站。

  13. Synthesis of poly(vinyl ether)s with perfluoroalkyl pendant groups

    NARCIS (Netherlands)

    Höpken, Jens; Möller, Martin; Lee, Myongsoo; Percec, Virgil

    1992-01-01

    2-Perfluoro(alkyl)ethyl vinyl ethers, F(CF2)nCH2CH2OCHCH2, (n = 6 or 8), were synthesized and polymerized by means of cationic initiators (HI/ZnI2 and CF3SO3H/(CH3)2S). The perfluorohexyl-substituted poly(vinyl ether) is completely amorphous. The polymer with perfluorooctyl segments shows side chain

  14. Zeolite-catalyzed methylation of pyrazole with dimethyl carbonate

    Energy Technology Data Exchange (ETDEWEB)

    Born, S.; Weichert, J.; Hartmann, M.; Ernst, S. [Dept. of Chemistry, Chemical Technology, Kaiserslautern Univ. (Germany)

    2002-07-01

    The present paper describes our attempts to explore the potential of acidic and nonacidic zeolites for the alkylation of pyrazole with dimethyl carbonate to 1-methyl pyrazole, which is a useful intermediate in the manufacture of pharmaceuticals and pesticides. (orig.)

  15. Preparation and characterization of monovalent ion selective cation exchange membranes based on sulphonated poly(ether ether ketone)

    NARCIS (Netherlands)

    Balster, J.H.; Krupenko, O.; Krupenko, O.; Punt, Ineke G.M.; Stamatialis, Dimitrios; Wessling, Matthias

    2005-01-01

    This paper analyses the separation properties of various commercial cation exchange membranes (CEMs) and tailor made membranes based on sulphonated poly(ether ether ketone) and poly(ether sulphone) for binary electrolyte solutions containing protons and calcium ions. All membranes are thoroughly

  16. Preparation and characterisation of monovalent ion selective cation exchange membranes based on sulphonated poly(ether ether ketone)

    NARCIS (Netherlands)

    Balster, J.; Krupenko, O.; Punt, I.G.M.; Stamatialis, D.; Wessling, M.

    2005-01-01

    This paper analyses the separation properties of various commercial cation exchange membranes (CEMs) and tailor made membranes based on sulphonated poly(ether ether ketone) and poly(ether sulphone) for binary electrolyte solutions containing protons and calcium ions. All membranes are thoroughly cha

  17. Tween as a Substitute for Diethyl Ether in the Formalin-Ether Sedimentation Technique

    Directory of Open Access Journals (Sweden)

    NA Ahmadi

    2007-10-01

    Full Text Available Background: Tween as a substitute for diethyl ether in the formalin-ether sedimentation technique was evaluated for para­site detection.Methods: Fresh fecal material free of parasites with 10% formalin to prepare standardized specimen was thoroughly pooled. This specimen was divided into 5 equal portions; one was without infection, and each of the others was individually seeded with Entamoeba coli, and Giardia lamblia cysts, ova of Ascaris lumbericoides, and Hymenolepis nana. Six hundred and eighty four slides including 228 stool samples for each of formalin-tween, formalin-ether and direct wet mount proce­dures were examined.Results: The sensitivity of above mentioned procedures were computed 72.1%, 55% and 30 %; their negative predictive value were 69.3%, 58.3% and 47.3%; and their false negative error rate were 27.9%, 45% and 70%, respectively. There were no false-positive results among the 264 specimens previously identified as negative for the presence of intestinal para­sites. Therefore, specificity for each technique was 100%.Conclusion: In the range of our study, formalin-tween method proved to be equivalent to or better than formalin-ether tech­nique in concentrating parasite eggs, and cysts, as well as in maintaining characteristic morphology. Tween is more stable, safer, cheaper, and less flammable than that of ether; and promises to be a useful alternative to ether.

  18. Thermal Sensitivity and Dimethyl Sulfoxide (DMSO).

    Science.gov (United States)

    Takeda, Kotaro; Pokorski, Mieczyslaw; Okada, Yasumasa

    2016-01-01

    Dimethyl sulfoxide (DMSO) is commonly used as a solvent for hydrophobic substances, but the compound's innate bioactivity is an area of limited understanding. In this investigation we seek to determine the analgesic potential of DMSO. We addressed the issue by assessing the perception of thermal pain stimulus, using a 55 °C hotplate design, in conscious mice. The latency of withdrawal behaviors over a range of incremental accumulative intraperitoneal DMSO doses (0.5-15.5 g/kg) in the same mouse was taken as a measure of thermal endurance. The findings were that the latency, on average, amounted to 15-30 s and it differed inappreciably between the sequential DMSO conditions. Nor was it different from the pre-DMSO control conditions. Thus, DMSO did not influence the cutaneous thermal pain perception. The findings do not lend support to those literature reports that point to the plausible antinociceptive potential of DMSO as one of a plethora of its innate bioactivities. However, the findings concern the mouse's footpad nociceptors which have specific morphology and stimulus transduction pathways, which cannot exclude DMSO's antinociceptive influence on other types of pain or in other types of skin. Complex and as yet unresolved neural mechanisms of perception of cutaneous noxious heat stimulus should be further explored with alternative experimental designs.

  19. Optimizing the Performance of a 50cc Compression Ignition Two-Stroke Engine Operating on Dimethyl Ether

    DEFF Research Database (Denmark)

    Hansen, Kim Rene; Dolriis, J.D.; Hansson, C.

    2011-01-01

    . Design improvements relative to an earlier prototype are described. The major alterations are related to air intake arrangement, exhaust tuning and the fuel injector. Comparison is made to the first prototype engine and the effects of fuel injection rate, injection pressure, cylinder head geometry...

  20. OXIDATION OF METHYL FLUORIDE AND DIMETHYL ETHER BY AMMONIA MONOOXYGENASE IN NITROSOMONAS EUROPAEA. (R825689C009)

    Science.gov (United States)

    The perspectives, information and conclusions conveyed in research project abstracts, progress reports, final reports, journal abstracts and journal publications convey the viewpoints of the principal investigator and may not represent the views and policies of ORD and EPA. Concl...

  1. Mechanistic and kinetic investigations on the role of methanol and dimethyl ether in the Methanol-To-Hydrocarbons reaction

    OpenAIRE

    Espín, Juan Salvador Martínez

    2017-01-01

    The main scope of this PhD thesis was to gain knowledge on the mechanistic and kinetic behavior of methanol and DME in the industrially relevant Methanol-To-Hydrocarbons (MTH) reaction with the use of zeolitic materials as catalysts. Industrial MTH processes use methanol, DME or combined methanol/DME feeds over zeolitic catalysts. Methanol and its dehydration product, DME, are conventionally attributed an analogous behavior in MTH; however, a thorough investigation on the theme is still missi...

  2. Technoeconomic analysis of a low CO2 emission dimethyl ether (DME) plant based on gasification of torrefied biomass

    DEFF Research Database (Denmark)

    Clausen, Lasse Røngaard; Elmegaard, Brian; Houbak, Niels

    2010-01-01

    process that takes place at 200–300°C. Torrefied biomass has properties similar to coal, which enables the use of commercially available coal gasification processing equipment. The DME plants are designed with focus on lowering the total CO2 emissions from the plants; this includes e.g. a recycle of a CO2...... loss in torrefaction, the total efficiencies are reduced to 64% (RC) and 58% (OT). The two plants produce DME at an estimated cost of $11.9/GJLHV (RC) and $12.9/GJLHV (OT). If a credit is given for storing the CO2 captured, the future costs may become as low as $5.4/GJLHV (RC) and $3.1/GJLHV (OT)....

  3. Bis[bis-(1-ethyl-benzimidazol-2-ylmeth-yl) ether]cobalt(II) dipicrate dimethyl-formamide disolvate.

    Science.gov (United States)

    Wu, Huilu; Yun, Ruirui; Sun, Tao; Li, Ke; Meng, Xuan

    2009-09-12

    In the title complex, [Co(C(20)H(22)N(4)O)(2)](C(6)H(2)N(3)O(7))(2)·2C(3)H(7)NO, the Co(II) ion is coordinated by two sets of two N atoms and an O atom from two independent tridendate ligands in a distorted octa-hedral coordination environment. There are significant differences between chemically equivalent coordination bond lengths. The crystal structure is stabilized by weak inter-molecular C-H⋯O hydrogen bonds and weak π-π stacking inter-actions [centroid-centroid distance 3.495 (1) Å]. In one of the anions one nitro group is rotationally disordered about the C-N bond with refined occupancies of 0.524 (8) and 0.476 (8).

  4. Preparation and characterization of polymer blend based on sulfonated poly (ether ether ketone) and polyetherimide (SPEEK/PEI) as proton exchange membranes for fuel cells

    Energy Technology Data Exchange (ETDEWEB)

    Hashim, Nordiana; Ali, Ab Malik Marwan [Ionic Material and Devices Research Laboratory, Institute of Science, Universiti Teknologi MARA, 40450 Shah Alam (Malaysia); Lepit, Ajis; Rasmidi, Rosfayanti [Faculty of Applied Sciences, Universiti Teknologi MARA Sabah, Beg Berkunci 71, 88997 Kota Kinabalu (Malaysia); Subban, Ri Hanum Yahaya [Faculty of Applied Sciences, Universiti Teknologi MARA, 40450 Shah Alam (Malaysia); Institute of Science, Universiti Teknologi MARA, 40450 Shah Alam (Malaysia); Yahya, Muhd Zu Azhan [Faculty of Defence Science & Technology, Universiti Pertahanan Nasional Malaysia, 57000 Kuala Lumpur (Malaysia)

    2015-08-28

    Blends of sulfonated poly (ether ether ketone) (SPEEK) and polyetherimide (PEI) were prepared in five different weight ratios using N-methyl-2-pyrrolidone (NMP) as solvent by the solution cast technique. The degree of sulfonation (DS) of the sulfonated PEEK was determined from deuterated dimethyl sulfoxide (DMSO-d{sub 6}) solution of the purified polymer using {sup 1}H NMR method. The properties studied in the present investigation includes conductivity, water uptake, thermal stability and structure analysis of pure SPEEK as well as SPEEK-PEI polymer blend membranes. The experimental results show that the conductivity of the membranes increased with increase in temperature from 30 to 80°C, except for that of pure SPEEK membrane which increased with temperature from 30 to 60°C while its conductivity decreased with increasing temperature from 60 to 80°C. The conductivity of 70wt.%SPEEK-30wt.%PEI blend membrane at 80% relative humidity (RH) is found to be 1.361 × 10{sup −3} Scm{sup −1} at 30°C and 3.383 × 10{sup −3} Scm{sup −1} at 80°C respectively. It was also found that water uptake and thermal stability of the membranes slightly improved upon blending with PEI. Structure analysis was carried out using Fourier Transform Infrared (FTIR) spectroscopy which revealed considerable interactions between sulfonic acid group of SPEEK and imide groups of PEI. Modification of SPEEK by blending with PEI shows good potential for improving the electrical and physical properties of proton exchange membranes.

  5. Ether- and Ester-Bound iso-Diabolic Acid and Other Lipids in Members of Acidobacteria Subdivision 4

    Science.gov (United States)

    Rijpstra, W. Irene C.; Hopmans, Ellen C.; Foesel, Bärbel U.; Wüst, Pia K.; Overmann, Jörg; Tank, Marcus; Bryant, Donald A.; Dunfield, Peter F.; Houghton, Karen; Stott, Matthew B.

    2014-01-01

    Recently, iso-diabolic acid (13,16-dimethyl octacosanedioic acid) has been identified as a major membrane-spanning lipid of subdivisions 1 and 3 of the Acidobacteria, a highly diverse phylum within the Bacteria. This finding pointed to the Acidobacteria as a potential source for the bacterial glycerol dialkyl glycerol tetraethers that occur ubiquitously in peat, soil, lakes, and hot springs. Here, we examined the lipid composition of seven phylogenetically divergent strains of subdivision 4 of the Acidobacteria, a bacterial group that is commonly encountered in soil. Acid hydrolysis of total cell material released iso-diabolic acid derivatives in substantial quantities (11 to 48% of all fatty acids). In contrast to subdivisions 1 and 3 of the Acidobacteria, 6 out of the 7 species of subdivision 4 (excepting “Candidatus Chloracidobacterium thermophilum”) contained iso-diabolic acid ether bound to a glycerol in larger fractional abundance than iso-diabolic acid itself. This is in agreement with the analysis of intact polar lipids (IPLs) by high-performance liquid chromatography-mass spectrometry (HPLC-MS), which showed the dominance of mixed ether-ester glycerides. iso-Diabolic acid-containing IPLs were not identified, because these IPLs are not released with a Bligh-Dyer extraction, as observed before when studying lipid compositions of subdivisions 1 and 3 of the Acidobacteria. The presence of ether bonds in the membrane lipids does not seem to be an adaptation to temperature, because the five mesophilic isolates contained a larger amount of ether lipids than the thermophile “Ca. Chloracidobacterium thermophilum.” Furthermore, experiments with Pyrinomonas methylaliphatogenes did not reveal a major influence of growth temperature over the 50 to 69°C range. PMID:24928878

  6. Inhibition of diethyl ether degradation in Rhodococcus sp. strain DEE5151 by glutaraldehyde and ethyl vinyl ether.

    Science.gov (United States)

    Kim, Yong-Hak; Engesser, Karl-Heinrich

    2005-02-15

    Alkyl ether-degrading Rhodococcus sp. strain DEE5151, isolated from activated sewage sludge, has an activity for the oxidation of a variety of alkyl ethers, aralkyl ethers and dibenzyl ether. The whole cell activity for diethyl ether oxidation was effectively inhibited by 2,3-dihydrofurane, ethyl vinyl ether and glutaraldehyde. Glutaraldehyde of less than 30 microM inhibited the activity by a competitive manner with the inhibition constant, K(I) of 7.07+/-1.36 microM. The inhibition type became mixed at higher glutaraldehyde concentrations >30 microM, probably due to the inactivation of the cell activity by the Schiff-base formation. Structurally analogous ethyl vinyl ether inhibited the diethyl ether oxidation activity in a mixed manner with decreasing the apparent maximum oxidation rate, v(max)(app), and increasing the apparent Michaelis-Menten constant, K(M)(app). The mixed type inhibition by ethyl vinyl ether seemed to be introduced not only by the structure similarity with diethyl ether, but also by the reactivity of the vinyl ether with cellular components in the whole cell system.

  7. Dimethyl trisulfide: A novel cyanide countermeasure.

    Science.gov (United States)

    Rockwood, Gary A; Thompson, David E; Petrikovics, Ilona

    2016-12-01

    In the present studies, the in vitro and in vivo efficacies of a novel cyanide countermeasure, dimethyl trisulfide (DMTS), were evaluated. DMTS is a sulfur-based molecule found in garlic, onion, broccoli, and similar plants. DMTS was studied for effectiveness as a sulfur donor-type cyanide countermeasure. The sulfur donor reactivity of DMTS was determined by measuring the rate of the formation of the cyanide metabolite thiocyanate. In experiments carried out in vitro in the presence of the sulfurtransferase rhodanese (Rh) and at the experimental pH of 7.4, DMTS was observed to convert cyanide to thiocyanate with greater than 40 times higher efficacy than does thiosulfate, the sulfur donor component of the US Food and Drug Administration-approved cyanide countermeasure Nithiodote(®) In the absence of Rh, DMTS was observed to be almost 80 times more efficient than sodium thiosulfate in vitro The fact that DMTS converts cyanide to thiocyanate more efficiently than does thiosulfate both with and without Rh makes it a promising sulfur donor-type cyanide antidote (scavenger) with reduced enzyme dependence in vitro The therapeutic cyanide antidotal efficacies for DMTS versus sodium thiosulfate were measured following intramuscular administration in a mouse model and expressed as antidotal potency ratios (APR = LD50 of cyanide with antidote/LD50 of cyanide without antidote). A dose of 100 mg/kg sodium thiosulfate given intramuscularly showed only slight therapeutic protection (APR = 1.1), whereas the antidotal protection from DMTS given intramuscularly at the same dose was substantial (APR = 3.3). Based on these data, DMTS will be studied further as a promising next-generation countermeasure for cyanide intoxication. © The Author(s) 2016.

  8. Emergent gravity and ether-drift experiments

    CERN Document Server

    Consoli, M

    2009-01-01

    In principle, ether-drift experiments could distinguish phenomenologically emergent-gravity approaches, where an effective curvature emerges from hydrodynamic distortions of the same physical, flat-space vacuum, from the more conventional scenario where curvature is considered a fundamental property of space-time down to extremely small length scales and the speed of light represents a universal constant. From an experimental point of view, in this particular context, besides time modulations that might be induced by the Earth's rotation (and its orbital revolution), one should also consider the possibility of random fluctuations of the signal. These might reflect the stochastic nature of the underlying 'quantum ether' and be erroneously interpreted as mere instrumental noise. To test the present interpretation, we have extracted the mean amplitude of the signal from various experiments with different systematics, operating both at room temperature and in the cryogenic regime. They all give the same consisten...

  9. Synthesis of New Liquid Crystalline Diglycidyl Ethers

    Directory of Open Access Journals (Sweden)

    Issam Ahmed Mohammed

    2012-01-01

    Full Text Available The phenolic Schiff bases I–VI were synthesized by condensation reactions between various diamines, namely o-dianisidine, o-tolidine and ethylenediamine with vanillin or p-hydroxybenzaldehyde and subsequent reactions between these phenolic Schiff bases and epichlorohydrin to produce new diglycidyl ethers Ia–VIa. The structures of these compounds were confirmed by CHN, FT-IR, 1H-NMR, and 13C-NMR spectroscopy. Their thermotropic liquid crystalline behavior was studied using differential scanning calorimetry (DSC and polarizing optical microscopy (POM. All the diglycidyl ethers prepared exhibit nematic mesophases, except for Va and VIa, which did not show any transition mesophases, but simply flow to liquids.

  10. Fluoroalkylation of aryl ether perfluorocyclobutyl polymers

    OpenAIRE

    Ligon, Clark; Ameduri, Bruno; Boutevin, Bernard; Smith, Dennis

    2008-01-01

    International audience; Post functionalization of aryl ether perfluorocyclobutyl (PFCB) polymers with fluoroalkyl side chains was accomplished with Umemoto's FITS reagents. The fluoroalkylated PFCB polymers (20 % functionalized) showed increases in both hydrophobicity and oleophobicity. Static contact angle for hexadecane was increased after fluoroalkylation from 0° to greater than 30° for the two PFCB polymers tested. Increased oil repellency makes these materials potential candidates for va...

  11. Catalytic intermolecular hydroamination of vinyl ethers.

    Science.gov (United States)

    Pahadi, Nirmal K; Tunge, Jon A

    2009-12-01

    This manuscript details the development of a palladium-catalyzed hydroamination of vinyl ethers. It is proposed that palladium catalyzes the hydroamination via Bronsted base catalysis, where palladium is protonated by the relatively acidic sulfonamide to generate a palladium hydride as well as the active anionic sulfonamide nucleophile. Thus, this process is distinct from known palladium-catalyzed hydroaminations of styrene derivatives that utilize less acidic amines.

  12. Nikola Tesla, the Ether and his Telautomaton

    Science.gov (United States)

    Milar, Kendall

    2014-03-01

    In the nineteenth century physicists' understanding of the ether changed dramatically. New developments in thermodynamics, energy physics, and electricity and magnetism dictated new properties of the ether. These have traditionally been examined from the perspective of the scientists re-conceptualizing the ether. However Nikola Tesla, a prolific inventor and writer, presents a different picture of nineteenth century physics. Alongside the displays that showcased his inventions he presented alternative interpretations of physical, physiological and even psychical research. This is particularly evident in his telautomaton, a radio remote controlled boat. This invention and Tesla's descriptions of it showcase some of his novel interpretations of physical theories. He offered a perspective on nineteenth century physics that focused on practical application instead of experiment. Sometimes the understanding of physical theories that Tesla reached was counterproductive to his own inventive work; other times he offered new insights. Tesla's utilitarian interpretation of physical theories suggests a more scientifically curious and invested inventor than previously described and a connection between the scientific and inventive communities.

  13. From ether theory to ether theology: Oliver Lodge and the physics of immortality.

    Science.gov (United States)

    Raia, Courtenay Grean

    2007-01-01

    This article follows the development of physicist Oliver Lodge's religio-scientific worldview, beginning with his reticent attraction to metaphysics in the early 1880s to the full formulation of his "ether theology" in the late 1890s. Lodge undertook the study of psychical phenomena such as telepathy, telekinesis, and "ectoplasm" to further his scientific investigations of the ether, speculating that electrical and psychical manifestations were linked phenomena that described the deeper underlying structures of the universe, beneath and beyond matter. For Lodge, to fully understand the ether was to force from the universe an ultimate Revelation, and psychical research, as the most modern and probatory science, was poised to replace religion as the means of that disclosure. (c) 2007 Wiley Periodicals, Inc.

  14. Synthesis of Diaryl Ethers, Diaryl Sulfides, Heteroaryl Ethers and Heteroaryl Sulfides under Microwave Heating

    Institute of Scientific and Technical Information of China (English)

    LI,Feng; ZOU,Jiong; WANG,Quan-Rui; TAO,Feng-Gang

    2004-01-01

    @@ Diaryl ether moiety is found in a pool of naturally occurring and medicinally important compounds.[1] As a consequent, considerable efforts have been devoted to the assembly of this framework.[2] Recently, we have developed a microwave heating version of the synthesis of diaryl ethers as well as aryl sulfides. Under our conditions, even the extremely electron-poor 4-nitrophenol works well and its reaction with 1-halo-4-nitrobenzenes produces 4-(nitrophenoxy)-benzonitriles in satisfactory yield. The scope of the present protocol has been expanded to hydroxylated six-membered heterocycles as well as 2-pyrimidinethiol with mildly activated aryl halides, affording heteroaryl ethers and respectively sulfides. The advantages of the present method include the wide substrate scope, no use of any metal catalysts, the ease of product isolation and high yields.

  15. Comparison of Properties among Dendritic and Hyperbranched Poly(ether ether ketone)s and Linear Poly(ether ketone)s.

    Science.gov (United States)

    Morikawa, Atsushi

    2016-02-16

    Poly(ether ether ketone) dendrimers and hyperbranched polymers were prepared from 3,5-dimethoxy-4'-(4-fluorobenzoyl)diphenyl ether and 3,5-dihydroxy-4'-(4-fluorobenzoyl)diphenyl ether through aromatic nucleophilic substitution reactions. 1-(tert-Butyldimethylsiloxy)-3,5-bis(4-fluorobenzoyl)benzene was polycondensed with bisphenols, followed by cleavage of the protective group to form linear poly(ether ketone)s having the same hydroxyl groups in the side chains as the chain ends of the dendrimer and hyperbranched polymers. Their properties, such as solubilities, reduced viscosities, and thermal properties, were compared with one another. Similar comparisons were also carried out among the corresponding methoxy group polymers, and the size of the molecules was shown to affect the properties.

  16. 76 FR 38026 - Diethylene Glycol Mono Butyl Ether; Exemption From the Requirement of a Tolerance

    Science.gov (United States)

    2011-06-29

    ... butyl ether, also a glycol ether differing in only one ethyl group from DEGBE. These data were used to... monobutyl ether, also a glycol ether differing only in one ethyl group. This data was used to assess the... AGENCY 40 CFR Part 180 Diethylene Glycol Mono Butyl Ether; Exemption From the Requirement of a...

  17. Azidated Ether-Butadiene-Ether Block Copolymers as Binders for Solid Propellants

    Science.gov (United States)

    Cappello, Miriam; Lamia, Pietro; Mura, Claudio; Polacco, Giovanni; Filippi, Sara

    2016-07-01

    Polymeric binders for solid propellants are usually based on hydroxyl-terminated polybutadiene (HTPB), which does not contribute to the overall energy output. Azidic polyethers represent an interesting alternative but may have poorer mechanical properties. Polybutadiene-polyether copolymers may combine the advantages of both. Four different ether-butadiene-ether triblock copolymers were prepared and azidated starting from halogenated and/or tosylated monomers using HTPB as initiator. The presence of the butadiene block complicates the azidation step and reduces the storage stability of the azidic polymer. Nevertheless, the procedure allows modifying the binder properties by varying the type and lengths of the energetic blocks.

  18. Phenolic ethers in the organic polymer of the Murchison meteorite

    Science.gov (United States)

    Hayatsu, R.; Winans, R. E.; Scott, R. G.; McBeth, R. L.; Moore, L. P.; Studier, M. H.

    1980-03-01

    Results of the oxidation of the organic polymer of the Murchison meteorite with alkaline cupric oxide, a mild-oxidant specific for cleaving ether linkages, are reported. Qualitative analyses by gas chromatography-mass spectrometry, solid-probe mass spectrometry and high-resolution mass spectrometry reveal the presence of large amounts of meta-hydroxybenzoic acid and 3-hydroxy-1,5-benzenedicarboxylic acid, along with seven phenolic acids, in the oxidized solution, indicating the presence of phenolic ethers and of aryl alkyl ethers having no nuclear hydroxy group in the meteorite. The formation of phenolic ethers in the solar nebula by Fischer-Tropsch type reactions is then discussed.

  19. Alcohol dehydration: Mechanism of ether formation using an alumina catalyst

    Energy Technology Data Exchange (ETDEWEB)

    Shi, B.; Davis, B.H. [Univ. of Kentucky, Lexington, KY (United States)

    1995-12-01

    Ether formation during the dehydration of secondary alcohols, namely, 2-butanol, 3-pentanol, and 1-cyclopentylethanol, was investigated. Using the proper reaction conditions, the yield of di-2-butyl ether during the dehydration of 2-butanol on alumina can be as high as 40%. That ether is formed by adding an alcohol to the alkene is ruled out by the results from deuterium tracer studies. Results from experiments using S(+)- 2-butanol suggest that the formation of di-2-butyl ether occurs by a S{sub N}2-type mechanism. 33 refs., 5 figs., 3 tabs.

  20. Synthesis of dimethyl-1,1 guanylguanidine-{sup 14}C-2,4 (dimethyl-1-1 biguanide) hydrochloride; Synthese du chlorhydrate de dimethyl-1,1 guanylguanidine {sup 14}C-2,4 (dimethyl-1-1 biguanide)

    Energy Technology Data Exchange (ETDEWEB)

    Herbert, M.; Pichat, L. [Commissariat a l' Energie Atomique, Saclay (France).Centre d' Etudes Nucleaires

    1961-07-01

    A description of the synthesis of dimethyl-1,1 guanylguanidine-{sup 14}C-2,4 hydrochloride passing through the {sup 14}C{sub 2} dicyandiamide. The overall yield with respect to Ba{sup 14}CO{sub 3} is 38 per cent. (author) [French] Description de la synthese du chlorhydrate de dimethyl-1,1 guanylguanidine {sup 14}C-2,4 par l'intermediaire de la dicyandiamide {sup 14}C{sub 2}. Le rendement global par rapport a {sup 14}CO{sub 3}Ba est de 38 pour cent. (auteur)

  1. Sequential analysis of dimethyl sulfur compounds in seawater

    Institute of Scientific and Technical Information of China (English)

    Meng Li; Dong Xing Yuan; Quan Long Li; Xiao Ying Jin

    2007-01-01

    A sequential method for the determination of dimethyl sulfur compounds, including dimethylsulfide (DMS), dimethylsulfoniopropionate (DMSP) and dimethylsulfoxide (DMSO), in seawater samples has been developed. Detection limit of 2.5 pmol of DMS in 25 mL sample, corresponding to 0.10 nmol/L, was achieved. Recoveries for dimethyl sulfur compounds were in the range of 68.6-78.3%. The relative standard deviations (R.S.D.s) for DMS, DMSP and DMSO determination were 3.0, 5.4 and 7.4%, respectively.

  2. Nitrogen Molecule-Dimethyl Sulfide Complex Investigated by Fourier Transform Microwave Spectroscopy and AB Initio Calculation

    Science.gov (United States)

    Kawashima, Yoshiyuki; Iwano, Sakae; Hirota, Eizi

    2016-06-01

    This paper presents an extension of the preceding talk on the FTMW spectroscopy of N_2-ES (ethylene sulfide), namely the results on N_2-DMS (dimethyl sulfide). We have previously investigated two N_2 complexes: N_2-DME (dimethyl ether), for which we reported a prelimanary result, and N_2-EO (ethylene oxide). We have observed the ground-state rotational spectrum of the N_2-DMS complex, i.e. c-type transitions in the frequency region from 5 to 24 GHz, which we assigned to the normal, 15N_2-DMS, and 15NN-DMS species of the N_2-DMS. We have found both the ortho and para states for the 14N_2-DMS and 15N_2-DMS species. In the case of the 15N_2-DMS, some transitions with Ka = 2 and 3 were observed slightly split by the internal rotation of the two methyl tops of the DMS. The observed spectra of the 15N_2-DMS were analyzed by using the XIAM program. In the case of the para state of the 15N_2-DMS, three rotational and five centrifugal distortion constants with the V3 barrier to the methyl group internal rotation, whereas, in the case of the ortho state of the 15N_2-DMS, two more centrifugal distortion constants, ΦJK and ΦKJ, were needed to reproduce the observed spectra. For the N_2-DMS complex, we concluded that the N_2 moiety was located in a plane perpendicular to the C-S-C plane and bisecting the CSC angle of the DMS. We have carried out ab initio molecular orbital calculations at the level of MP2 with basis sets 6-311++G(d, p), aug-cc-pVDZ, and aug-cc-pVTZ, to complement the information on the intracomplex motions obtained from the observed rotational spectra. We have applied a natural bond orbital (NBO) analysis to the N_2-DMS and N_2-ES to calculate the stabilization energy CT (=Δ Eσσ*), which was closely correlated with the binding energy EB, as found for other related complexes. Y. Kawashima, Y. Tatamitani, Y. Morita, and E. Hirota, 61st International Symposium on Molecular Spectroscopy, TE10 (2006) Y. Kawashima and E. Hirota, J. Phys. Chem. A 2013 117, 13855

  3. Lithiated and sulphonated poly(ether ether ketone) solid state electrolyte films for supercapacitors

    Energy Technology Data Exchange (ETDEWEB)

    Chiu, K.-F.; Su, S.-H., E-mail: minimono42@gmail.com

    2013-10-01

    Poly(ether ether ketone) (PEEK) films have been synthesised and used as solid-state electrolytes for supercapacitors. In order to increase their ion conductivity, the PEEK films were sulphonated by sulphuric acid, and various amounts of LiClO{sub 4} were added. The solid-state electrolyte films were characterised by Fourier transform infrared spectroscopy, scanning electron microscopy, energy-dispersive X-ray spectroscopy, and thermogravimetric analysis. The ionic conductivities of the electrolyte films were analysed by performing electrochemical impedance spectroscopy. The obtained electrolyte films can be sandwiched or directly coated on activated carbon electrodes to form solid-state supercapacitors. The electrochemical characteristics of these supercapacitors were investigated by performing cyclic voltammetry and charge–discharge tests. Under an optimal content of LiClO{sub 4}, the supercapacitor can provide a capacitance as high as 190 F/g. After 1000 cycles, the supercapacitors show almost no capacitance fading, indicating high stability of the solid-state electrolyte films. - Highlights: • Poly(ether ether ketone) (PEEK) films have been used as solid-state electrolytes. • LiClO4 addition can efficiently improve the ionic conductivity. • Supercapacitors using PEEK electrolyte films deliver high capacitance.

  4. Syntheses and GABA uptake properties of 6-ether- and 6-enol ether-substituted nipecotic acids.

    Science.gov (United States)

    N'Goka, Victor; Bissantz, Caterina; Bisel, Philippe; Stenbøl, Tine B; Krogsgaard-Larsen, Povl; Schlewer, Gilbert

    2004-07-01

    6-aralkylether- and 6-arylenol-ether-substituted nipecotic acids were synthesized. These analogues are poor GABA uptake inhibitors. The electronegative region concept developed in the N-substituted nipecotic acid series cannot be transferred on the side chain of this series of 6-substituted analogues.

  5. Novel high T{sub g} high-strength poly(aryl ether)s

    Energy Technology Data Exchange (ETDEWEB)

    Banerjee, S.; Maier, G. [Technische Univ. Muenchen, Garching (Germany). Lehrstuhl fuer Makromolekulare Stoffe

    1999-08-01

    A novel 2-perfluoroalkyl-activated bisfluoro monomer has been synthesized successfully using a Pd(0)-catalyzed cross-coupling reaction of 4-fluoro-3-trifluoromethyl phenyl boronic acid with 4,4{prime}-dibromodiphenylbenzene. This monomer was converted to novel poly(aryl ether)s by nucleophilic displacement of the fluorine atoms on the benzene ring with several bisphenols. The products obtained by displacement of the fluorine atoms exhibit weight average molar masses up to 1.06 {times} 10{sup 5} g/mol in GPC. These poly(aryl ether)s showed outstanding thermooxidative stability up to 534 C for 5% weight loss in TGA under synthetic air and high glass transition temperatures (T{sub g}) even up to 300 C in DSC and DMTA. These polymers are soluble in a wide range of organic solvents, e.g., CHCl{sub 3}, THF, NMP, DMF, toluene, etc., and are insoluble in DMSO and acetone. Transparent thin films of these polymers cast from DMF exhibited tensile strengths up to 115 MPa, moduli up to 2.59 GPa, and elongations up to 120% depending on their exact repeating unit structures. These values are comparable to those of high performance thermoplastic materials such as PEEK or Ultem PEI.

  6. Novel high T[sub g] high-strength poly(aryl ether)s

    Energy Technology Data Exchange (ETDEWEB)

    Banerjee, S.; Maier, G. (Technische Univ. Muenchen, Garching (Germany). Lehrstuhl fuer Makromolekulare Stoffe)

    1999-08-01

    A novel 2-perfluoroalkyl-activated bisfluoro monomer has been synthesized successfully using a Pd(0)-catalyzed cross-coupling reaction of 4-fluoro-3-trifluoromethyl phenyl boronic acid with 4,4[prime]-dibromodiphenylbenzene. This monomer was converted to novel poly(aryl ether)s by nucleophilic displacement of the fluorine atoms on the benzene ring with several bisphenols. The products obtained by displacement of the fluorine atoms exhibit weight average molar masses up to 1.06 [times] 10[sup 5] g/mol in GPC. These poly(aryl ether)s showed outstanding thermooxidative stability up to 534 C for 5% weight loss in TGA under synthetic air and high glass transition temperatures (T[sub g]) even up to 300 C in DSC and DMTA. These polymers are soluble in a wide range of organic solvents, e.g., CHCl[sub 3], THF, NMP, DMF, toluene, etc., and are insoluble in DMSO and acetone. Transparent thin films of these polymers cast from DMF exhibited tensile strengths up to 115 MPa, moduli up to 2.59 GPa, and elongations up to 120% depending on their exact repeating unit structures. These values are comparable to those of high performance thermoplastic materials such as PEEK or Ultem PEI.

  7. 75 FR 28804 - An Exposure Assessment of Polybrominated Diphenyl Ethers (PBDEs)

    Science.gov (United States)

    2010-05-24

    ... AGENCY An Exposure Assessment of Polybrominated Diphenyl Ethers (PBDEs) AGENCY: Environmental Protection...'s 2006 Polybrominated Diphenyl Ethers (PBDEs) Project Plan. This document ] provides an assessment of the exposure of Americans to polybrominated diphenyl ethers (PBDEs), a class of brominated...

  8. New ways to derivatize at position 6 of 7,7-dimethyl-7,8-dihydropterin

    OpenAIRE

    Shi, Genbin; Ji, Xinhua

    2011-01-01

    Reported are the synthesis of two intermediates for derivatization at position 6 of 7,7-dimethyl-7,8-dihydropterin: 6-carboxylic acid ethyl ester-7,7-dimethyl-7,8-dihydropterin, which is a novel compound, and 6-aldehyde-7,7-dimethyl-7,8-dihydropterin, which is synthesized by a new method with a yield of 90%.

  9. Radiolabeled dimethyl branched long chain fatty acid for heart imaging

    Science.gov (United States)

    Knapp, Jr., Furn F.; Goodman, Mark M.; Kirsch, Gilbert

    1988-08-16

    A radiolabeled long chain fatty acid for heart imaging that has dimethyl branching at one of the carbons of the chain which inhibits the extent to which oxidation can occur. The closer to the carboxyl the branching is positioned, the more limited the oxidation, thereby resulting in prolonged retention of the radiolabeled compound in the heart.

  10. Arginine dimethylation products in pediatric patients with chronic kidney disease

    Directory of Open Access Journals (Sweden)

    Akram E. El-Sadek

    2016-08-01

    Conclusion: Disturbed serum levels of arginine and its dimethyl derivatives may underlie development and/or progression of CKD. Elevated serum SDMA level is strongly correlated with impaired kidney functions and could be considered as a predictor for kidney functions deterioration and CKD progression.

  11. Dimethyl fumarate: a new oral treatment option for multiple sclerosis

    Directory of Open Access Journals (Sweden)

    Sarjana S. Atal

    2013-12-01

    Full Text Available Multiple Sclerosis (MS is a slowly progressive, immunologically mediated disease of the CNS. The recent years have witnessed great efforts in establishing new therapeutic options for multiple sclerosis. There is a clear need for more effective, safe and at the same time orally available treatment options. Here we review the recently approved drug Dimethyl fumarate (DMF, Tecfidera® as a new therapeutic option for MS and its role in context to the existing oral treatment options for MS. Dimethyl fumarate is the methyl ester of fumaric acid and has been claimed to possess immunomodulatory properties and is already in clinical use as Fumaderm for severe systemic psoriasis. In addition, Dimethyl fumarate was also shown to act on the blood-brain barrier and exert neuroprotective properties via activation of anti-oxidative pathways and displayed beneficial effects in experimental autoimmune encephalomyelitis (EAE, a model mimicking many aspects of MS. Based on two global phase III studies. Dimethyl fumarate has been clinically proven to significantly reduce important measures of disease activity, including relapses and development of brain lesions, as well as to slow disability progression over time, while demonstrating a favourable safety and tolerability profile. [Int J Basic Clin Pharmacol 2013; 2(6.000: 849-856

  12. Response of soil organisms to dimethyl disulfide fumigation

    Science.gov (United States)

    After the commonly used soil fumigant methyl bromide (MeBr) was phased out in the United States, alternatives to MeBr such as dimethyl disulfide (DMDS) which is known to have broad pest control spectrum, is increasingly used. However, effectiveness of DMDS has been mainly investigated to study targe...

  13. Application of simplified PC-SAFT to glycol ethers

    DEFF Research Database (Denmark)

    Avlund, Ane Søgaard; Kontogeorgis, Georgios; Michelsen, Michael Locht

    2012-01-01

    The simplified PC-SAFT (sPC-SAFT) equation of state is applied for binary glycol ether-containing mixtures, and it is investigated how the results are influenced by inclusion of intramolecular association in the association theory. Three different glycol ethers are examined: 2-methoxyethanol, 2-e...

  14. Congenital malformations and maternal occupational exposure to glycol ethers

    NARCIS (Netherlands)

    Cordier, S; Bergeret, A; Goujard, J; Ha, MC; Ayme, S; Calzolari, E; DeWalle, HEK; KnillJones, R; Candela, S; Dale, [No Value; Dananche, B; deVigan, C; Fevotte, J; Kiel, G; Mandereau, L

    1997-01-01

    Glycol ethers are found in a wide range of domestic and industrial products, many of which are used in women's work environments. Motivated by concern about their potential reproductive toxicity, we have evaluated the risk of congenital malformations related to glycol ether exposure during preg nanc

  15. Characterization of Poly(ether)urethanes - High Resolution Thermogravimetric Analysis

    Science.gov (United States)

    2004-02-01

    ether)urethanes.11 Table 5. Percent weight loss for steps in stepwise isothermal TGA analysis .......................... 14 viii DRDC Atlantic...Stepwise isothermal plots for the six poly(ether)urethanes. Table 5. Percent weight loss for steps in stepwise isothermal TGA analysis . SAMPLE/ % WT LOSS

  16. Effects of dimethyl fumarate on neuroprotection and immunomodulation

    Directory of Open Access Journals (Sweden)

    Albrecht Philipp

    2012-07-01

    Full Text Available Abstract Background Neuronal degeneration in multiple sclerosis has been linked to oxidative stress. Dimethyl fumarate is a promising novel oral therapeutic option shown to reduce disease activity and progression in patients with relapsing-remitting multiple sclerosis. These effects are presumed to originate from a combination of immunomodulatory and neuroprotective mechanisms. We aimed to clarify whether neuroprotective concentrations of dimethyl fumarate have immunomodulatory effects. Findings We determined time- and concentration-dependent effects of dimethyl fumarate and its metabolite monomethyl fumarate on viability in a model of endogenous neuronal oxidative stress and clarified the mechanism of action by quantitating cellular glutathione content and recycling, nuclear translocation of transcription factors, and the expression of antioxidant genes. We compared this with changes in the cytokine profiles released by stimulated splenocytes measured by ELISPOT technology and analyzed the interactions between neuronal and immune cells and neuronal function and viability in cell death assays and multi-electrode arrays. Our observations show that dimethyl fumarate causes short-lived oxidative stress, which leads to increased levels and nuclear localization of the transcription factor nuclear factor erythroid 2-related factor 2 and a subsequent increase in glutathione synthesis and recycling in neuronal cells. Concentrations that were cytoprotective in neuronal cells had no negative effects on viability of splenocytes but suppressed the production of proinflammatory cytokines in cultures from C57BL/6 and SJL mice and had no effects on neuronal activity in multi-electrode arrays. Conclusions These results suggest that immunomodulatory concentrations of dimethyl fumarate can reduce oxidative stress without altering neuronal network activity.

  17. Carbon-carbon bond cleavage of 1,2-hydroxy ethers b7 vanadium(V) dipicolinate complexes

    Energy Technology Data Exchange (ETDEWEB)

    Hanson, Susan K [Los Alamos National Laboratory; Gordon, John C [Los Alamos National Laboratory; Thorn, David L [Los Alamos National Laboratory; Scott, Brian L [Los Alamos National Laboratory; Baker, R Tom [Los Alamos National Laboratory

    2009-01-01

    ), 2-phenoxyethanol (B), and 1,2-diphenyl-2-methoxyethanol (C) (Figure 1). Reaction of (dipic)V{sup V}(O)O{sup i}Pr (1a) or (dipic)V{sup v}(O)OEt (lb) with A, B, or C in acetonitrile yielded new vanadium(V) complexes where the alcohol-ether ligand was bound in a chelating fashion. From the reaction of 1b with pinacol monomethyl ether (A) in acetonitrile solution, (dipic)V{sup v}(O)(pinOMe) (2) (PinOMe = 2,3-dimethyl-3-methoxy-2-butanoxide) was isolated in 61 % yield. Reaction of 1b with 2-phenoxyethanol (B) in acetonitrile gave the new complex (dipic)V{sup v}(O)(OPE) (3) (OPE = 2-phenoxyethoxide), which was isolated in 76% yield. In a similar fashion, 1a reacted with 1,2-diphenyl-2-methoxyethanol (C) to give (dipic)V(O)(DPME) (4) (DPME = 1,2-diphenyl-2-methoxyethoxide), which was isolated in 39% yield. Complexes 2, 3, and 4 were characterized by {sup 1}H NMR and IR spectroscopy, elemental analysis, and X-ray crystallography. Compared to the previously reported vanadium(V) pinacolate complex (dipic)V(O)(pinOH) the X-ray structure of complex 2 reveals a slightly shorter V = O bond, 1.573(2) {angstrom} vs 1.588(2) {angstrom} for the pinOH structure. Complexes 3 and 4 display similar vanadium oxo bond distances of 1.568(2) {angstrom} and 1.576(2) {angstrom}, respectively. All three complexes show longer bonds to the ether-oxygen trans to the oxo (2.388(2) {angstrom} for 2, 2.547(2) {angstrom} for 3, and 2.438(2) {angstrom} for 4) than to the hydroxy-oxygen in the pinOH structure (2.252(2) {angstrom}).

  18. Toxic effects of decabromodiphenyl ether (BDE-209 on human embryonic kidney cells

    Directory of Open Access Journals (Sweden)

    Min eLi

    2014-05-01

    Full Text Available Polybrominated diphenyl ethers (PBDEs are widely used as flame-retardant additives in consumer and household products and can escape into the environment over time. PBDEs have become a global environmental organic pollutant due to the properties of persistence, toxicity, and bioaccumulation. The well-studied toxic effects of PBDEs mainly include thyroid hormone disruption and neurotoxicity. There is no consistent conclusions on the carcinogenic potential of PBDEs to date. Here, we explored the toxic effects of BDE-209 on human embryonic kidney cells (HEK293T. The comparison of the gene expression profiles of HEK293T cells with BDE-209 treatment and the negative control found that BDE-209 exposure may alter nucleosome organization through significantly changing the expression of histone gene clusters. The remodeled chromatin structure could further disturb systemic lupus erythematosus as one of the toxic effects of BDE-209. Additionally, gene sets of different cancer modules are positively correlated with BDE-209 exposure. This suggests that BDE-209 has carcinogenic potential for a variety of tumors. Collectively, BDE-209 has a broader toxicity not limited to disruption of thyroid hormone-related biological processes. Notably, the toxic effects of BDE-209 dissolved in dimethyl sulfoxide (DMSO is not the simply additive effects of BDE-209 and DMSO alone.

  19. Electrochemical Polymerization of Carbazole in Acetic Acid Containing Boron Trifluoride Diethyl Etherate

    Institute of Scientific and Technical Information of China (English)

    MIAO,Hua-Ming; ZHANG,Hong-Lin; XU,Jing-Kun; FAN,Chang-Li; DONG,Bin; ZENG,Li-Qiang; ZHAO,Feng

    2008-01-01

    High-quality polycarbazole (PCz) films with an electrical conductivity of 10-2 S·cm-1 were synthesized elec-trochemically by direct anodic oxidation of carbazole in a novel mixed electrolyte of acetic acid containing 26% boron trifluoride diethyl etherate (BTDE) and 5% poly(ethylene glycol) with molar mass of 400 (by volume). The oxidation potential of carbazole in this medium was measured to be only 0.89 V vs. a saturated calomel electrode (SCE), which was much lower than that determined in acetonitrile containing 0.1mol·L-1 Bu4NBF4 (1.36 V vs. SCE). PCz films obtained from this medium showed good electrochemical behavior, good thermal stability, and were partly soluble in strong polar organic solvents such as dimethyl sulfoxide and tetrahydrofuran. The fluorescence spectra implied that PCz obtained from this medium was a good blue-light emitter. FT-IR, 1H NMR and theoretical studies showed that the polymerization of carbazole mainly occurred at the 3,6-positions. To the best of our knowledge, this is the first report on the electrosyntheses of conducting polymers in mixed electrolyte of acetic acid and BTDE.

  20. Ethylated Urea - Ether - Modified Urea - Formaldehyde Resins,

    Directory of Open Access Journals (Sweden)

    Mathew Obichukwu EDOGA

    2006-07-01

    Full Text Available First, phenol - formaldehyde (PF and urea - formaldehyde (UFII resins were separately conventionally prepared in our laboratory. Also, UF resin synthesized from the acid modified synthesis procedure was synthesized in a purely acid medium of pH 1.0, FU molar ratio of 1.0 and at 50oC (one-stage acid modified-synthesis procedure. Subsequently, the UF resin II was modified during synthesis by incorporating ethylated urea-ether (EUER (i.e. UFIII and glycerol (GLYC (i.e. UFV cured with and without acid curing agent. The structural and physicochemical analyses of the various resin samples were carried out.The results showed that the unmodified UF resin (UF II synthesized in acid medium of pH 1.0, F/U molar ratio 1.0, and at 50oC, cured in absence of acid curing catalyst, showed features in their spectra which are consistent with a tri-, and/or tetra-substituted urea in the reaction to give a 3 - dimensional network cured UF resin. Modification of the UF resin(UF II with ethylated urea-ether and glycerol to produce UF resins III and respectively V prominently increased the absorbance of methylene and ether groups in the spectra which are consistent with increased hydrophobicity and improved hydrolytic stability. For the conventional UF resin (UF I, the only clear distinction between spectra for the UF resin II and UF resins (III/V is the presence of diminished peaks for methylene groups at 2.2 ppm. The relationship between the logarithmic viscosity of cured PF resin with time showed continuos dependence of viscosity with time during cure up to 70 minutes. Similar trends were shown by UF resins (III/V, cured in absence of acid catalyst. In contrast, the conventional UF resins I and UF IV (i.e. UF II cured with NH4CL showed abrupt discontinuity in viscosity with time just after about 20 minutes of cure.

  1. Polymeric 32-channel arrayed waveguide grating multiplexer using fluorinated poly (ether ether ketone)

    Institute of Scientific and Technical Information of China (English)

    Fei Wang(王菲); Wei Sun(孙伟); Aize Li(李艾泽); Maobin Yi(衣茂斌); Zhenhua Jiang(姜振华); Daming Zhang(张大明)

    2004-01-01

    In wavelength division multiplexing (WDM) systems, an arrayed waveguide grating (AWG) multiplexer is a key component. A polymeric AWG multiplexer has recently attracted much attention due to its low cost processing and a potential of integration with other devices. Fluorinated poly (ether ether ketone)(FPEEK) is excellent material for fabrication of optical waveguides due to its low absorption loss at 1.55-μm wavelength and high thermal stability. A 32-channel AWG multiplexer has been designed based on the grating diffraction theory and fabricated using newly synthesized FPEEK. During the fabrication process of the Polymer/Si AWG device, spin coating, vaporizing, photolithographic patterning and reactive ion etching (RIE) are used. The AWG multiplexer measurement system is based on a tunable semiconductor laser, infrared camera and a Peltier-type heater. The device exhibits a wavelength channel spacing of 0.8nm and a center wavelength of 1548 nm in the room temperature.

  2. Origin of mechanical modifications in poly (ether ether ketone)/carbon nanotube composite

    Energy Technology Data Exchange (ETDEWEB)

    Pavlenko, Ekaterina; Puech, Pascal; Bacsa, Wolfgang, E-mail: wolfgang.bacsa@cemes.fr [CEMES-CNRS and University of Toulouse, 29 Jeanne Marvig, 31055 Toulouse (France); Boyer, François; Olivier, Philippe [Université de Toulouse, Institut Clément Ader, I.U.T. Université Paul Sabatier - 133C Avenue de Rangueil - B.P. 67701, 31077 Toulouse CEDEX 4 (France); Sapelkin, Andrei [School of Physics and Astronomy, Queen Mary, University of London, Mile End Road, E1 4NS London (United Kingdom); King, Stephen; Heenan, Richard [ISIS Facility, Rutherford Appleton Laboratory, Chilton, OX11 0QX Didcot (United Kingdom); Pons, François; Gauthier, Bénédicte; Cadaux, Pierre-Henri [AIRBUS FRANCE (B.E. M and P Toulouse), 316 Route de Bayonne, 31060 Toulouse (France)

    2014-06-21

    Variations in the hardness of a poly (ether ether ketone) beam electrically modified with multi-walled carbon nanotubes (MWCNT, 0.5%-3%) are investigated. It is shown that both rupture and hardness variations correlate with the changes in carbon nanotube concentration when using micro indentation and extended Raman imaging. Statistical analysis of the relative spectral intensities in the Raman image is used to estimate local tube concentration and polymer crystallinity. We show that the histogram of the Raman D band across the image provides information about the amount of MWCNTs and the dispersion of MWCNTs in the composite. We speculate that we have observed a local modification of the ordering between pure and modified polymer. This is partially supported by small angle neutron scattering measurements, which indicate that the agglomeration state of the MWCNTs is the same at the concentrations studied.

  3. Sulfonated poly(tetramethydiphenyl ether ether ketone) membranes for vanadium redox flow battery application

    Energy Technology Data Exchange (ETDEWEB)

    Mai, Zhensheng; Bi, Cheng; Dai, Hua [PEMFC Key Materials and Technology Laboratory, Dalian Institute of Chemical Physics, Chinese Academy of Sciences, Zhongshan Road 457, Dalian 116023 (China); Graduate University of the Chinese Academy of Sciences, Beijing 100039 (China); Zhang, Huamin; Li, Xianfeng [PEMFC Key Materials and Technology Laboratory, Dalian Institute of Chemical Physics, Chinese Academy of Sciences, Zhongshan Road 457, Dalian 116023 (China)

    2011-01-01

    Sulfonated poly(tetramethydiphenyl ether ether ketone) (SPEEK) with various degree of sulfonation is prepared and first used as ion exchange membrane for vanadium redox flow battery (VRB) application. The vanadium ion permeability of SPEEK40 membrane is one order of magnitude lower than that of Nafion 115 membrane. The low cost SPEEK membranes exhibit a better performance than Nafion at the same operating condition. VRB single cells with SPEEK membranes show very high energy efficiency (>84%), comparable to that of the Nafion, but at much higher columbic efficiency (>97%). In the self-discharge test, the duration of the cell with the SPEEK membrane is two times longer than that with Nafion 115. The membrane keeps a stable performance after 80-cycles charge-discharge test. (author)

  4. Modification of Poly(ether ether ketone Polymer for Fuel Cell Application

    Directory of Open Access Journals (Sweden)

    Devesh Shukla

    2013-01-01

    Full Text Available Polyelectrolyte membrane (PEM is an important part of PEM fuel cell. Nafion is a commercially known membrane which gives the satisfactory result in PEM fuel cell operating at low temperature. Present research paper includes functionalization of Poly(ether ether ketone (PEEK polymer with phosphonic acid group. The functionalization was done with the help of nickel-based catalyst. Further, the polymer was characterized by the FTIR, EDAX, DSC, TGA, and 1H NMR, and it was found that PEEK polymer was functionalized with phosphonic acid group with good thermal stability in comparison to virgin PEEK. Finally, the thin films of functionalized polymer were prepared by solution casting method, and proton conductivity of film samples was measured by impedance spectra whose value was found satisfactory with good thermal stability in comparison to commercially available Nafion membrane.

  5. Evaluation of Stabilization Performances of Antioxidants in Poly(ether ether ketone)

    Institute of Scientific and Technical Information of China (English)

    ZHOU Zheng; ZHOU Fu-gui; ZHANG Shu-ling; MU Jian-xin; YUE Xi-gui; WANG Gui-bin

    2012-01-01

    Two types of antioxidants(a primary antioxidant and a secondary antioxidant) were used to improve the stability of poly(ether ether ketone)(PEEK).The effects of the antioxidants on the properties of PEEK and the stabilization mechanism were investigated by some characterization methods,such as rheometer,thermogravinetric analysis(TGA),universal tester and electron spin resonance(ESR).The results indicate that the efficiency of the phosphorous antioxidant(DS) in improving the stability of PEEK was better than that of the phenolic antioxidant(DN) in both melting stability and thermal stability,and the thermal stability of PEEK sample containing 0.07%(mass fraction) DS was the best among all the samples due to the decrease of the free radicals density,as proven by ESR measurement.Additionally,no obvious changes could be observed in mechanical properties of PEEK containing antioxidants compared to those of virgin PEEK.

  6. Sulfonated poly(tetramethydiphenyl ether ether ketone) membranes for vanadium redox flow battery application

    Science.gov (United States)

    Mai, Zhensheng; Zhang, Huamin; Li, Xianfeng; Bi, Cheng; Dai, Hua

    Sulfonated poly(tetramethydiphenyl ether ether ketone) (SPEEK) with various degree of sulfonation is prepared and first used as ion exchange membrane for vanadium redox flow battery (VRB) application. The vanadium ion permeability of SPEEK40 membrane is one order of magnitude lower than that of Nafion 115 membrane. The low cost SPEEK membranes exhibit a better performance than Nafion at the same operating condition. VRB single cells with SPEEK membranes show very high energy efficiency (>84%), comparable to that of the Nafion, but at much higher columbic efficiency (>97%). In the self-discharge test, the duration of the cell with the SPEEK membrane is two times longer than that with Nafion 115. The membrane keeps a stable performance after 80-cycles charge-discharge test.

  7. Dielectric properties of poly (1,4-phenylene ether-ether-sulfone)

    CERN Document Server

    Spasevska, H

    2002-01-01

    Dielectric properties of Poly (1,4-phenylene ether-ether-sulfone) are obtained from dielectric spectroscopy of the polymer pellet. The values of relative dielectric constant epsilon', dielectric losses epsilon sup , dielectric dissipation factor tan delta and complex impedance are obtained at temperature of 75 sup o C. The temperature dependence of these parameters is investigated for three frequencies (8x10 sup 4 Hz; 8x10 sup 5 Hz; 8x10 sup 6 Hz) of applied electric field. The specific conductivity sigma, which depends on temperature, is related to the ohmic resistance R, at temperature in the interval from 66 to 83 sup o C. Fitting the experimental data, the value of the activation energy U is obtained. (Original)

  8. Poly(vinylbenzyl sulfonic acid)-grafted poly(ether ether ketone) membranes

    Energy Technology Data Exchange (ETDEWEB)

    Hwang, Mi-Lim; Choi, Jisun; Woo, Hyun-Su; Kumar, Vinod; Sohn, Joon-Yong; Shin, Junhwa, E-mail: shinj@kaeri.re.kr

    2014-02-15

    Highlights: • PEEK-g-PVBSA, a polymer electrolyte membrane was prepared by a radiation grafting technique. • Poly(ether ether ketone) (PEEK), an aromatic hydrocarbon polymer was used as a grafting backbone film. • The water uptake, proton conductivity, and methanol permeability of the membranes were evaluated. • PEEK-g-PVBSA membranes show considerably lower methanol permeability compared to a Nafion membrane. -- Abstract: In this study, an aromatic hydrocarbon based polymer electrolyte membrane, poly(vinylbenzyl sulfonic acid)-grafted poly(ether ether ketone) (PEEK-g-PVBSA), has been prepared by the simultaneous irradiation grafting of vinylbenzyl chloride (VBC) monomer onto a PEEK film and subsequent sulfonation. Each chemical conversion was monitored by FT-IR and SEM–EDX instruments. The physicochemical properties including IEC, water uptake, proton conductivity, and methanol permeability of the prepared membranes were also investigated and found that the values of these properties increase with the increase of degree of grafting. It was observed that the IEC values of the prepared PEEK-g-PVBSA membranes with 32%, 58%, and 80% DOG values were 0.50, 1.05, and 1.22 meq/g while the water uptakes were 14%, 20%, and 21%, respectively. The proton conductivities (0.0272–0.0721 S/cm at 70 °C) were found to be somewhat lower than Nafion 212 (0.126 S/cm at 70 °C) at a relative humidity of 90%. However, the prepared membranes showed a considerably lower methanol permeability (0.61–1.92 × 10{sup −7} cm{sup 2}/s) compared to a Nafion 212 membrane (5.37 × 10{sup −7} cm{sup 2}/s)

  9. Mass transport of direct methanol fuel cell species in sulfonated poly(ether ether ketone) membranes

    Energy Technology Data Exchange (ETDEWEB)

    Silva, V.S.; Boaventura, M.; Mendes, A.M.; Madeira, L.M. [LEPAE, Chemical Engineering Department, Faculty of Engineering, University of Porto, Rua Dr. Roberto Frias, 4200-465 Porto (Portugal); Ruffmann, B.; Vetter, S.; Nunes, S.P. [GKSS Research Centre, Max-Planck Str., 21502 Geesthacht (Germany)

    2006-05-05

    Homogeneous membranes based on sulfonated poly(ether ether ketone) (sPEEK) with different sulfonation degrees (SD) were prepared and characterized. In order to perform a critical analysis of the SD effect on the polymer barrier and mass transport properties towards direct methanol fuel cell species, proton conductivity, water/methanol pervaporation and nitrogen/oxygen/carbon dioxide pressure rise method experiments are proposed. This procedure allows the evaluation of the individual permeability coefficients in hydrated sPEEK membranes with different sulfonation degrees. Nafion{sup (R)} 112 was used as reference material. DMFC tests were also performed at 50{sup o}C. It was observed that the proton conductivity and the permeability towards water, methanol, oxygen and carbon dioxide increase with the sPEEK sulfonation degree. In contrast, the SD seems to not affect the nitrogen permeability coefficient. In terms of selectivity, it was observed that the carbon dioxide/oxygen selectivity increases with the sPEEK SD. In contrast, the nitrogen/oxygen selectivity decreases. In terms of barrier properties for preventing the DMFC reactants loss, the polymer electrolyte membrane based on the sulfonated poly(ether ether ketone) with SD lower or equal to 71%, although having slightly lower proton conductivity, presented much better characteristics for fuel cell applications compared with the well known Nafion{sup (R)} 112. In terms of the DMFC tests of the studied membranes at low temperature, the sPEEK membrane with SD=71% showed to have similar performance, or even better, as that of Nafion{sup (R)} 112. However, the highest DMFC overall efficiency was achieved using sPEEK membrane with SD=52%. (author)

  10. Microwave Spectrum of the Ethylmethyl Ether Molecule

    Directory of Open Access Journals (Sweden)

    Kojiro Takagi

    2003-01-01

    Full Text Available We have observed rotational transitions of ethylmethyl ether (CH3CH2OCH3 in the 24-110 GHz frequency range. We newly assigned the transitions of four Q-branch series for J=1-38 with Ka=0-5 and six R-branch series of b-type transitions for J=7-37 with Ka=0-3. All these assigned transitions were observed to be split into two or four components due to the internal rotations of the methyl groups. We analyzed the averaged frequencies of the split components on the basis of the Watson A-reduced Hamiltonian, neglecting the effect of the internal rotations. A total of 122 transitions were fitted to eight molecular parameters to a 1s standard deviation of 24 kHz. The parameters A, B, C and DJ were improved, and DJK, Dk, dJ and dK were determined for the first time.

  11. Thermolysis of phenethyl phenyl ether: A model of ether linkages in low rank coal

    Energy Technology Data Exchange (ETDEWEB)

    Britt, P.F.; Buchanan, A.C. III; Malcolm, E.A.

    1994-09-01

    Currently, an area of interest and frustration for coal chemists has been the direct liquefaction of low rank coal. Although low rank coals are more reactive than bituminous coals, they are more difficult to liquefy and offer lower liquefaction yields under conditions optimized for bituminous coals. Solomon, Serio, and co-workers have shown that: in the pyrolysis and liquefaction of low rank coals, a low temperature cross-linking reaction associated with oxygen functional groups occurs before tar evolution. A variety of pretreatments (demineralization, alkylation, and ion-exchange) have been shown to reduce these retrogressive reactions and increase tar yields, but the actual chemical reactions responsible for these processes have not been defined. In order to gain insight into the thermochemical reactions leading to cross-linking in low rank coal, we have undertaken a study of the pyrolysis of oxygen containing coal model compounds. Solid state NMR studies suggest that the alkyl aryl ether linkage may be present in modest amounts in low rank coal. Therefore, in this paper, we will investigate the thermolysis of phenethyl phenyl ether (PPE) as a model of 0-aryl ether linkages found in low rank coal, lignites, and lignin, an evolutionary precursor of coal. Our results have uncovered a new reaction channel that can account for 25% of the products formed. The impact of reaction conditions, including restricted mass transport, on this new reaction pathway and the role of oxygen functional groups in cross-linking reactions will be investigated.

  12. Cationic Poly(benzyl ether)s as Self-Immolative Antimicrobial Polymers.

    Science.gov (United States)

    Ergene, Cansu; Palermo, Edmund F

    2017-10-09

    Self-immolative polymers (SIMPs) are macromolecules that spontaneously undergo depolymerization into small molecules when triggered by specific external stimuli. We report here the first examples of antimicrobial SIMPs with potent, rapid, and broad-spectrum bactericidal activity. Their antibacterial and hemolytic activities were examined as a function of cationic functionality. Polymers bearing primary ammonium cationic groups showed more potent bactericidal activity against Escherichia coli, relative to tertiary and quaternary ammonium counterparts, whereas the quaternary ammonium polymers showed the lowest hemolytic toxicity. These antibacterial polycations undergo end-to-end depolymerization when triggered by an externally applied stimulus. Specifically, poly(benzyl ether)s end-capped with a silyl ether group and bearing pendant allyl side chains were converted to polycations by photoinitiated thiol-ene radical addition using cysteamine HCl. The intact polycations are stable in solution, but they spontaneously unzip into their component monomers upon exposure to fluoride ions, with excellent sensitivity and selectivity. Upon triggered depolymerization, the antibacterial potency was largely retained but the hemolytic toxicity was substantially reduced. Thus, we reveal the first example of a self-immolative antibacterial polymer platform that will enable antibacterial materials to spontaneously unzip into biologically active small molecules upon the introduction of a specifically designed stimulus.

  13. High temperature fuel cell membranes based on poly(arylene ether)s containing benzimidazole groups

    Energy Technology Data Exchange (ETDEWEB)

    Kim, Dae Sik [Los Alamos National Laboratory; Kim, Yu Seung [Los Alamos National Laboratory; Lee, Kwan - Soo [Los Alamos National Laboratory; Boncella, James M [Los Alamos National Laboratory; Kuiper, David [Los Alamos National Laboratory; Guiver, Michael D [CANADA

    2009-01-01

    Development of new high-performance polymer membranes that retain their proton conductivity under low humidity conditions is one of the most critical requirements to commercialize PEMFC systems. Current sulfonated proton exchange membranes acquire proton conductivity by water that solvates ion and carries proton. Consequently, a loss of water under low RH conditions immediately results in a loss of proton conductivity. One approach to maintain proton conductivity under low RH conditions is to replace water with a less volatile proton solvent. Kreuer has pointed out the possibility to develop fully polymeric proton-conducting membranes based on nitrogen-containing heterocycles such as imidazole, benzimidazole, and pyrazole. We have attempted to blend those less volatile proton solvent with sulfonated copolymers such as polystyrene sulfonic acid, Nafion, poly(arylene ether sulfone, BPSH-xx). [Ref. DOE review meeting 2007 and 2008] However, we observed that imidazole was slowly sublimated out as temperature and humidity increases which could cause poisoning of electro-catalyst, corrosion and losing conductivity. In this presentation, we report the synthesis of novel poly(arylene ether sulfone)s containing benzimidazole groups These benzimidazole containing polymer was blended with sulfonated poly(arylene ether sulfone). In the blend system, benzimidazole group attached to the polysulfone acts as a medium through the basic nitrogen for transfer of protons between the sulfonic acid groups. Proton conductivity of the blend membranes was investigated as a function of water content at 80 C and compared the performance with water based proton conduction system.

  14. Formulating liquid ethers for microtubular SOFCs

    Science.gov (United States)

    Kendall, Kevin; Slinn, Matthew; Preece, John

    One of the key problems of applying solid oxide fuel cells (SOFCs) in transportation is that conventional fuels like kerosene and diesel do not operate directly in SOFCs without prereforming to hydrogen and carbon monoxide which can be handled by the nickel cermet anode. SOFCs can internally reform certain hydrocarbon molecules such as methanol and methane. However, other liquid fuels usable in petrol or diesel internal combustion engines (ICEs) have not easily been reformable directly on the anode. This paper describes a search for liquid fuels which can be mixed with petrol or diesel and also injected directly into an SOFC without destroying the nickel anode. When fuel molecules such as octane are injected onto the conventional nickel/yttria stabilised zirconia (Ni/YSZ) SOFC fuel electrode, the anode rapidly becomes blocked by carbon deposition and the cell power drops to near zero in minutes. This degeneration of the anode can be inhibited by injection of air or water into the anode or by some upstream reforming just before entry to the SOFC. Some smaller molecules such as methane, methanol and methanoic acid produce a slight tendency to carbon deposition but not sufficient to prevent long term operation. In this project we have investigated a large number of molecules and now found that some liquid ethers do not significantly damage the anode when directly injected. These molecules and formulations with other components have been evaluated in this study. The theory put forward in this paper is that carbon-carbon bonds in the fuel are the main reason for anode damage. By testing a number of fuels without such bonds, particularly liquid ethers such as methyl formate and dimethoxy methane, it has been shown that SOFCs can run without substantial carbon formation. The proposal is that conventional fuels can be doped with these molecules to allow hybrid operation of an ICE/SOFC device.

  15. Vapor intrusion risk of fuel ether oxygenates methyl tert-butyl ether (MTBE), tert-amyl methyl ether (TAME) and ethyl tert-butyl ether (ETBE): A modeling study.

    Science.gov (United States)

    Ma, Jie; Xiong, Desen; Li, Haiyan; Ding, Yi; Xia, Xiangcheng; Yang, Yongqi

    2017-06-15

    Vapor intrusion of synthetic fuel additives represents a critical yet still neglected problem at sites contaminated by petroleum fuel releases. This study used an advanced numerical model to investigate the vapor intrusion potential of fuel ether oxygenates methyl tert-butyl ether (MTBE), tert-amyl methyl ether (TAME), and ethyl tert-butyl ether (ETBE). Simulated indoor air concentration of these compounds can exceed USEPA indoor air screening level for MTBE (110μg/m(3)). Our results also reveal that MTBE has much higher chance to cause vapor intrusion problems than TAME and ETBE. This study supports the statements made by USEPA in the Petroleum Vapor Intrusion (PVI) Guidance that the vertical screening criteria for petroleum hydrocarbons may not provide sufficient protectiveness for fuel additives, and ether oxygenates in particular. In addition to adverse impacts on human health, ether oxygenate vapor intrusion may also cause aesthetic problems (i.e., odour and flavour). Overall, this study points out that ether oxygenates can cause vapor intrusion problems. We recommend that USEPA consider including the field measurement data of synthetic fuel additives in the existing PVI database and possibly revising the PVI Guidance as necessary.

  16. Characterization of Microsolvated Crown Ethers from Broadband Rotational Spectroscopy

    Science.gov (United States)

    Perez, Cristobal; Schnell, Melanie; Blanco, Susana; Lopez, Juan Carlos

    2016-06-01

    Since they were first synthetized, crown ethers have been extensively used in organometallic chemistry due to their unparalleled binding selectivity with alkali metal cations. From a structural point of view, crown ethers are heterocycles containing oxygen and/or other heteroatoms, although the most common ones are formed from ethylene oxide unit. Crown ethers are conventionally seen as being hydrophilic inside and hydrophobic outside when the structures found for the metal cation complexes are considered. However, crown ethers are extremely flexible and in isolation may present a variety of stable conformations so that their structure may be easily adapted in presence of a strong ligand as an alkali metal cation minimize the energy of the resulting complex. Water can be considered a soft ligand which interacts with crown ethers through moderate hydrogen bonds. It is thus interesting to investigate which conformers are selected by water to form complexes, the preferred interaction sites and the possible conformational changes due to the presence of one or more water molecules. Previous studies identified microsolvated crown ethers but in all cases with a chromophore group attached to the structure. Here we present a broadband rotational spectroscopy study of microsolvated crown ethers produced in a pulsed molecular jet expansion. Several 1:1 and 1:2 crown ether:water aggregates are presented for 12-crown-4, 15-crown-5 and 18-crown-6. Unambiguous identification of the structures has been achieved using isotopic substitution within the water unit. The subtle changes induced in the structures of the crown ether monomer upon complexation and the hydrogen-bonding network that hold them together will be also discussed. F. Gámez, B. Martínez-Haya, S. Blanco,J. C. López and J. L. Alonso, Phys. Chem. Chem. Phys. 2014, 14 12912-12918 V. A. Shubert, C.W. Müller and T. Zwier, J. Phys. Chem. A 2009, 113 8067-8079

  17. Oligomer formation during gas-phase ozonolysis of small alkenes and enol ethers: new evidence for the central role of the Criegee Intermediate as oligomer chain unit

    Directory of Open Access Journals (Sweden)

    A. Sadezky

    2007-10-01

    Full Text Available An important fraction of secondary organic aerosol (SOA formed by atmospheric oxidation of diverse volatile organic compounds (VOC has recently been shown to consist of high-molecular weight oligomeric species. In our previous study (Sadezky et al., 2006, we reported the identification and characterization of oligomers as main constituents of SOA from gas-phase ozonolysis of small enol ethers. These oligomers contained repeated chain units of the same chemical composition as the main Criegee Intermediates (CI formed during the ozonolysis reaction, which were CH2O2 (mass 46 for alkyl vinyl ethers (AVE and C2H4O2 (mass 60 for ethyl propenyl ether (EPE. In the present work, we extend our previous study (Sadezky et al., 2006 to another enol ether (ethyl butenyl ether EBE and a variety of structurally related small alkenes (trans-3-hexene, trans-4-octene and 2,3-dimethyl-2-butene.

    Experiments have been carried out in a 570 l spherical glass reactor at atmospheric conditions in the absence of seed aerosol. SOA formation was measured by a scanning mobility particle sizer (SMPS. SOA filter samples were collected and chemically characterized off-line by ESI(+/MS-TOF and ESI(+/MS/MS-TOF, and elemental compositions were confirmed by ESI(+/MS/MS-FTICR. The results for all investigated unsaturated compounds are in excellent agreement with the observations of our previous study (Sadezky et al., 2006. Analysis of the collected SOA filter samples reveal the presence of oligomeric compounds in the mass range 200 to 800 u as major constituents. The repeated chain units of these oligomers are shown to systematically have the same chemical composition as the respective main Criegee Intermediate (CI formed during ozonolysis of the unsaturated compounds, which is C3H6O2 (mass 74 for ethyl butenyl ether (EBE, trans-3-hexene, and 2,3-dimethyl-2-butene

  18. Oligomer formation during gas-phase ozonolysis of small alkenes and enol ethers: new evidence for the central role of the Criegee Intermediate as oligomer chain unit

    Science.gov (United States)

    Sadezky, A.; Winterhalter, R.; Kanawati, B.; Römpp, A.; Spengler, B.; Mellouki, A.; Le Bras, G.; Chaimbault, P.; Moortgat, G. K.

    2008-05-01

    An important fraction of secondary organic aerosol (SOA) formed by atmospheric oxidation of diverse volatile organic compounds (VOC) has recently been shown to consist of high-molecular weight oligomeric species. In our previous study (Sadezky et al., 2006), we reported the identification and characterization of oligomers as main constituents of SOA from gas-phase ozonolysis of small enol ethers. These oligomers contained repeated chain units of the same chemical composition as the main Criegee Intermediates (CI) formed during the ozonolysis reaction, which were CH2O2 (mass 46) for alkyl vinyl ethers (AVE) and C2H4O2 (mass 60) for ethyl propenyl ether (EPE). In the present work, we extend our previous study to another enol ether (ethyl butenyl ether EBE) and a variety of structurally related small alkenes (trans-3-hexene, trans-4-octene and 2,3-dimethyl-2-butene). Experiments have been carried out in a 570 l spherical glass reactor at atmospheric conditions in the absence of seed aerosol. SOA formation was measured by a scanning mobility particle sizer (SMPS). SOA filter samples were collected and chemically characterized off-line by ESI(+)/TOF MS and ESI(+)/TOF MS/MS, and elemental compositions were determined by ESI(+)/FTICR MS and ESI(+)/FTICR MS/MS. The results for all investigated unsaturated compounds are in excellent agreement with the observations of our previous study. Analysis of the collected SOA filter samples reveal the presence of oligomeric compounds in the mass range 200 to 800 u as major constituents. The repeated chain units of these oligomers are shown to systematically have the same chemical composition as the respective main Criegee Intermediate (CI) formed during ozonolysis of the unsaturated compounds, which is C3H6O2 (mass 74) for ethyl butenyl ether (EBE), trans-3-hexene, and 2,3-dimethyl-2-butene, and C4H8O2 (mass 88) for trans-4-octene. Analogous fragmentation pathways among the oligomers formed by gas-phase ozonolysis of the different

  19. Oligomer formation during gas-phase ozonolysis of small alkenes and enol ethers: new evidence for the central role of the Criegee Intermediate as oligomer chain unit

    Directory of Open Access Journals (Sweden)

    A. Sadezky

    2008-05-01

    Full Text Available An important fraction of secondary organic aerosol (SOA formed by atmospheric oxidation of diverse volatile organic compounds (VOC has recently been shown to consist of high-molecular weight oligomeric species. In our previous study (Sadezky et al., 2006, we reported the identification and characterization of oligomers as main constituents of SOA from gas-phase ozonolysis of small enol ethers. These oligomers contained repeated chain units of the same chemical composition as the main Criegee Intermediates (CI formed during the ozonolysis reaction, which were CH2O2 (mass 46 for alkyl vinyl ethers (AVE and C2H4O2 (mass 60 for ethyl propenyl ether (EPE. In the present work, we extend our previous study to another enol ether (ethyl butenyl ether EBE and a variety of structurally related small alkenes (trans-3-hexene, trans-4-octene and 2,3-dimethyl-2-butene.

    Experiments have been carried out in a 570 l spherical glass reactor at atmospheric conditions in the absence of seed aerosol. SOA formation was measured by a scanning mobility particle sizer (SMPS. SOA filter samples were collected and chemically characterized off-line by ESI(+/TOF MS and ESI(+/TOF MS/MS, and elemental compositions were determined by ESI(+/FTICR MS and ESI(+/FTICR MS/MS. The results for all investigated unsaturated compounds are in excellent agreement with the observations of our previous study. Analysis of the collected SOA filter samples reveal the presence of oligomeric compounds in the mass range 200 to 800 u as major constituents. The repeated chain units of these oligomers are shown to systematically have the same chemical composition as the respective main Criegee Intermediate (CI formed during ozonolysis of the unsaturated compounds, which is C3H6O2 (mass 74 for ethyl butenyl ether (EBE, trans-3-hexene, and 2,3-dimethyl-2-butene, and C4H8

  20. Time evolution of dimethyl carbinol in water vortex rings

    Science.gov (United States)

    Omocea, Ioana-Laura; Damian, Iulia-Rodica; Simionescu, Štefan-Mugur; Bǎlan, Corneliu; Mihǎilescu, Mona

    2015-02-01

    The paper is concerned with the experimental study of the time evolution of a single laminar vortex ring generated at the interface between water and dimethyl carbinol. The experiments were performed by the submerged injection with a constant rate of dimethyl carbinol (isopropyl alcohol) in a water tank. The dynamics of the vortex formation was recorded at 1000 fps with a Photron Fastcam SA1 camera, equipped with a microscopic Edmund Optics objective. A symmetrical buoyant vortex ring with an elongated topology was observed at the interface between the two immiscible liquids. The analyses of the time dependence of the vortex rings disclosed three regions for the evolution of the interface: one dominated by inertia force, a transition region and a third region, dominated by buoyancy force.

  1. Dimethyl-ammonium 3-carb-oxy-benzoate.

    Science.gov (United States)

    Siddiqui, Tausif; Koteswara Rao, Vandavasi; Zeller, Matthias; Lovelace-Cameron, Sherri R

    2012-06-01

    The asymmetric unit of the title organic salt, C(2)H(8)N(+)·C(8)H(5)O(4) (-), consists of two dimethyl-ammonium cations and two 3-carb-oxy-benzoate anions. The 3-carb-oxy-benzoate anions are linked via strong inter-molecular and nearly symmetrical O-H⋯O hydrogen bonds forming infinite chains parallel to [111]. Neighbouring chains are further connected by the dimethyl-ammonium cations via N-H⋯O bonds, resulting in a double-chain-like structure. The dihedral angles of all carboxylate groups with respect to the phenylene rings are in the range 7.9 (1)-20.48 (9)°.

  2. 德国赫优讯EtherCAT新产品

    Institute of Scientific and Technical Information of China (English)

    2008-01-01

    EtherCAT作为实时以太网协议之一,以其强大的性能和“On the fly”的速度,以及网络抖动小于1μs的同步功能.成为发展最快的实时网络协议。同时,EtherCAT全球组织在中国代表处的设立,表明了EtherCAT全球组织对中国市场的关心。

  3. Impact of cellulose ethers on the cement paste microstructure

    OpenAIRE

    Pourchez, Jérémie; Grosseau, Philippe; Rouèche-Pourchez, Emilie; Debayle, Johan; Pinoli, Jean-Charles; Maire, Eric; Boller, Elodie; Parra-Denis, Estelle

    2007-01-01

    ISBN = 3-87264-022-4 7 pages; International audience; Complementary investigation tools (2D and 3D observations by optical microscopy and fast X-ray microtomography and then image analysis) were developed in order to examine the effects of cellulose ethers on the cement paste microstructure. The obtained results show that the presence of cellulose ether may induce an increase of both 50-250 µm-diameter air voids. The chemistry of the cellulose ethers appears as a main controlling factor of th...

  4. Crystal structure of dichloridobis(dimethyl N-cyanodithioiminocarbonatezinc

    Directory of Open Access Journals (Sweden)

    Mouhamadou Birame Diop

    2016-03-01

    Full Text Available The ZnII atom in the title complex, [ZnCl2(C4H6N2S22], is coordinated in a distorted tetrahedral manner by two Cl atoms and two terminal N atoms of two dimethyl N-cyanodithioiminocarbonate ligands. In the crystal, the complex molecules are connected through C—H...Cl hydrogen bonds and Cl...S contacts, leading to a two-dimensional structure extending parallel to the ab plane.

  5. Regioselective synthesis of chiral dimethyl-bis(ethylenedithiotetrathiafulvalene sulfones

    Directory of Open Access Journals (Sweden)

    Flavia Pop

    2015-07-01

    Full Text Available Enantiopure (R,R and (S,S-dimethyl-bis(ethylenedithiotetrathiafulvalene monosulfones have been synthesized by the aerial oxidation of the chiral dithiolates generated from the propionitrile-protected precursors. Both enantiomers crystallize in the orthorhombic chiral space group P212121. They show a boat-type conformation of the TTF moiety, a rather rigid dithiin sulfone ring and the methyl groups in a bisequatorial conformation. Cyclic voltammetry measurements indicate fully reversible oxidation in radical cation and dication species.

  6. Hexakis(dimethyl sulfoxide-κOcobalt(III trinitrate

    Directory of Open Access Journals (Sweden)

    Qiuhong Li

    2010-01-01

    Full Text Available The metal atom of the title salt, [Co(C2H6OS6](NO33, is coordinated by six dimethyl sulfoxide molecules in an octahedral geometry. The metal atom lies on a special position of overline{3} site symmetry. One of the nitrate ions lies on a special position of 3 site symmetry and the other independent ion is disordered about a special position of overline{3} site symmetry.

  7. Synthesis and Adsorption Property of Dihydroxyl Azacrown Ether-Grafted Chitosan

    Institute of Scientific and Technical Information of China (English)

    2002-01-01

    A novel dihydroxyl azacrown ether chitosan was synthesized by reacting dihydroxyl azacrown ether with epoxy activated chitosan. The adsorption property of the azacrown ether chitosan for Pb2+, Cr3+, and Ag+, were determined. The experimental results showed that the dihydroxyl azacrown ether grafted chitosan has high adsorption capacity and high selectivity for some metal ions.

  8. Diapause prevention effect of Bombyx mori by dimethyl sulfoxide.

    Directory of Open Access Journals (Sweden)

    Takayuki Yamamoto

    Full Text Available HCl treatment has been, for about 80 years, the primary method for the prevention of entry into embryonic diapauses of Bombyx mori. This is because no method is as effective as the HCl treatment. In this study, we discovered that dimethyl sulfoxide (DMSO prevented entry into the diapause of the silkworm, Bombyx mori. The effect of diapause prevention was 78% as a result of treatment with 100% DMSO concentration, and the effect was comparable to that of the HCl treatment. In contrast, in the case of non-diapause eggs, hatchability was decreased by DMSO in a concentration-dependent manner. The effect of DMSO was restricted within 24 hours after oviposition of diapause eggs, and the critical period was slightly shorter than the effective period of the HCl treatment. DMSO analogs, such as dimethyl formamide (DMF and dimethyl sulfide (DMS, did little preventive effect against the diapause. Furthermore, we also investigated the permeation effects of chemical compounds by DMSO. When treated with an inhibitor of protein kinase CK2 (CK2 dissolved in DMSO, the prevention rate of the diapause was less than 40%. This means that the inhibition effect by the CK2 inhibitor was the inhibition of embryonic development after diapause prevention by DMSO. These data suggest that DMSO has the effects of preventing from entering into the diapause and permeation of chemicals into diapause eggs.

  9. Fragrance material review on 2,2-dimethyl-3-phenylpropanol.

    Science.gov (United States)

    Scognamiglio, J; Jones, L; Letizia, C S; Api, A M

    2012-09-01

    A toxicologic and dermatologic review of 2,2-dimethyl-3-phenylpropanol when used as a fragrance ingredient is presented. 2,2-Dimethyl-3-phenylpropanol is a member of the fragrance structural group Aryl Alkyl Alcohols and is a primary alcohol. The AAAs are a structurally diverse class of fragrance ingredients that includes primary, secondary, and tertiary alkyl alcohols covalently bonded to an aryl (Ar) group, which may be either a substituted or unsubstituted benzene ring. The common structural element for the AAA fragrance ingredients is an alcohol group -C-(R1)(R2)OH and generically the AAA fragrances can be represented as an Ar-C-(R1)(R2)OH or Ar-Alkyl-C-(R1)(R2)OH group. This review contains a detailed summary of all available toxicology and dermatology papers that are related to this individual fragrance ingredient and is not intended as a stand-alone document. Available data for 2,2-dimethyl-3-phenylpropanol were evaluated then summarized and includes physical properties, acute toxicity, skin irritation, mucous membrane (eye) irritation, skin sensitization, phototoxicity, and photoallergy data. A safety assessment of the entire Aryl Alkyl Alcohols will be published simultaneously with this document; please refer to Belsito et al. (2012) for an overall assessment of the safe use of this material and all Aryl Alkyl Alcohols in fragrances. Copyright © 2011 Elsevier Ltd. All rights reserved.

  10. Evaluation of crystallization kinetics of poly (ether-ketone-ketone and poly (ether-ether-ketone by DSC

    Directory of Open Access Journals (Sweden)

    Gibran da Cunha Vasconcelos

    2010-08-01

    Full Text Available The poly (aryl ether ketones are used as matrices in advanced composites with high performance due to its high thermal stability, excellent environmental performance and superior mechanical properties. Most of the physical, mechanical and thermodynamic properties of semi-crystalline polymers depend on the degree of crystallinity and morphology of the crystalline regions. Thus, a study on the crystallization process promotes a good prediction of how the manufacturing parameters affect the developed structure, and the properties of the final product. The objective of this work was to evaluate the thermoplastics polymers PEKK e PEEK by DSC, aiming to obtain the relationship between kinetics, content, nucleation and geometry of the crystalline phases, according to the parameters of the Avrami and Kissinger models. The analysis of the Avrami exponents obtained for the studied polymers indicates that both showed the formation of crystalline phases with heterogeneous nucleation and growth geometry of the type sticks or discs, depending on the cooling conditions. It was also found that the PEEK has a higher crystallinity than PEKK.

  11. Spatial trends of polybrominated diphenyl ether (PBDE) congeners

    Data.gov (United States)

    National Oceanic and Atmospheric Administration, Department of Commerce — Spatial trends of polybrominated diphenyl ether (PBDE) congeners were analyzed in young of the year bluefish collected along the U.S. Atlantic coastline from...

  12. Fluorinated Alkyl Ether Epoxy Resin Compositions and Applications Thereof

    Science.gov (United States)

    Wohl, Christopher J. (Inventor); Connell, John W. (Inventor); Smith, Joseph G. (Inventor); Siochi, Emilie J. (Inventor); Gardner, John M. (Inventor); Palmieri, Frank M. (Inventor)

    2017-01-01

    Epoxy resin compositions prepared using amino terminated fluoro alkyl ethers. The epoxy resin compositions exhibit low surface adhesion properties making them useful as coatings, paints, moldings, adhesives, and fiber reinforced composites.

  13. 德国赫优讯EtherCAT产品

    Institute of Scientific and Technical Information of China (English)

    2008-01-01

    德国赫优讯自动化系统有限公司作为EtherCAT国际组织的重要成员之一,推出基于实时以太网EtherCAT的计算机通信板卡cifX系列产品和嵌入式通信模块comX系列产品。

  14. Nickel-catalyzed direct synthesis of dialkoxymethane ethers

    Indian Academy of Sciences (India)

    MURUGAN SUBARAMANIAN; ABHIJIT BERA; BHAGAVATULA L V PRASAD; EKAMBARAM BALARAMAN

    2017-08-01

    A simple and efficient method for the preparation of dialkoxymethane ethers (oxymethylene ethers) from alcohols and paraformaldehyde in the presence of commercially available nickel(II) salt is described. The reaction proceeds readily under neutral, solvent-free conditions using paraformaldehyde as a C1 source. The present strategy has a broad substrate scope including aliphatic (both primary and secondary) and aromatic alcohols and provides a benign method for the preparation of symmetrical dialkoxymethanes in good yields (up to 89%).

  15. Imide/Arylene Ether Copolymers Containing Phosphine Oxide

    Science.gov (United States)

    Jensen, Brian J.; Partos, Richard D.

    1993-01-01

    Phosphine oxide groups react with oxygen to form protective phosphate surface layers. Series of imide/arylene ether block copolymers containing phosphine oxide units in backbone synthesized and characterized. In comparison with commercial polyimide, these copolymers display better resistance to etching by oxygen plasma. Tensile strengths and tensile moduli greater than those of polyarylene ether homopolymer. Combination of properties makes copolymers attractive for films, coatings, adhesives, and composite matrices where resistance to atomic oxygen needed.

  16. Marine Sponge Dysidea herbacea revisited: Another Brominated Diphenyl Ether

    Directory of Open Access Journals (Sweden)

    Bruce F. Bowden

    2005-03-01

    Full Text Available Abstract: A pentabrominated phenolic diphenyl ether (1 that has not previously been reported from marine sources has been isolated from Dysidea herbacea collected at Pelorus Island, Great Barrier Reef, Australia. The structure was determined by comparison of NMR data with those of known structurally-related metabolites. NMR spectral assignments for (1 are discussed in context with those of three previously reported isomeric pentabrominated phenolic diphenyl ethers.

  17. Effect of diethyl ether on the biliary excretion of acetaminophen.

    Science.gov (United States)

    Watkins, J B; Siegers, C P; Klaassen, C D

    1984-10-01

    The biliary and renal excretion of acetaminophen and its metabolites over 8 hr was determined in rats exposed to diethyl ether by inhalation for 1 hr. Additional rats were anesthetized with urethane (1 g/kg ip) while control animals were conscious throughout the experiment (surgery was performed under hexobarbital narcosis: 150 mg/kg ip; 30-min duration). The concentration of UDP-glucuronic acid was decreased 80% in livers from ether-anesthetized rats but was not reduced in urethane-treated animals when compared to that in control rats. The concentration of reduced glutathione was not affected by either urethane or diethyl ether. Basal bile flow was not altered by the anesthetic agents. Bile flow rate after acetaminophen injection (100 mg/kg iv) was increased slightly over basal levels for 2 hr in hexobarbital-treated control rats, was unaltered in urethane-anesthetized animals, and was decreased throughout the 8-hr experiment in rats exposed to diethyl ether for 1 hr. In control and urethane-anesthetized animals, approximately 30-35% of the total acetaminophen dose (100 mg/kg iv) was excreted into bile in 8 hr, while only 16% was excreted in rats anesthetized with diethyl ether. Urinary elimination (60-70% of the dose) was not altered by exposure to ether. Separation of metabolites by reverse-phase high-pressure liquid chromatography showed that ether decreased the biliary elimination of unchanged acetaminophen and its glucuronide, sulfate, and glutathione conjugates by 47, 40, 49, and 73%, respectively, as compared to control rats. Excretion of unchanged acetaminophen and the glutathione conjugate into bile was depressed in urethane-anesthetized animals by 45 and 66%, respectively, whereas elimination of the glucuronide and sulfate conjugates was increased by 27 and 50%, respectively. These results indicate that biliary excretion is influenced by the anesthetic agent and that diethyl ether depresses conjugation with sulfate and glutathione as well as glucuronic

  18. Advanced hybrid fluoropolymers from the cycloaddition of aryl trifluorovinyl ethers

    Science.gov (United States)

    Ligon, S. Clark, Jr.

    This dissertation discusses the synthesis of aryl trifluorovinyl ethers and their cycloaddition polymerization to give perfluorocyclobutyl (PFCB) polymers. To explore the stereochemistry of these polymers, simple monomfunctional aryl trifluorovinyl ethers were dimerized and the resultant cis and trans isomers were separated. Differences in structure help to improve understanding of the amorphous nature of the bulk PFCB polymeric material. To apply this knowledge, crown ether containing perfluorocyclobutyl (PFCB) polymers were synthesized for use in lithium ion battery applications. While poor solubility has hindered further development of these materials, slight modifications to structure may provide a solution. Also described is a fluorinated aryl vinyl ether and its attempted copolymerization with chlorotrifluoroethylene. While this copolymerization did not yield the desired materials, novel semifluorinated phenol precursors have been utilized in reactions with carboxylic acids to give polyesters and most recently with phosgene like species to give polycarbonates. Next, PFCB polymers were post functionalized with fluoroalkyl tethers to improve oleophobicity and hydrophobicity without decreasing thermal stability or optical clarity. In addition, various silica nanostructures were functionalized with aryl trifluorovinyl ethers. This includes the reaction of aryl silanes to give trifluorovinyl ether functional POSS and their polymerization to provide PFCB hybrid materials. Silane coupling agents were also used to functionalize colloidal silica and fumed silica nanoparticles. These procedures allow excellent dispersion of the silica nanoparticles throughout the fluoropolymer matrix. Finally, the reaction of aryl trifluorovinyl ether with nonfluorinated alkenes and alkynes was explored. In these reactions, the fluorinated olefin adds with the hydrocarbon olefin to give semifluorinated cyclobutanes (SFCB) and with the alkyne to give semifluorinated cyclobutene. The

  19. Effects of the ether phospholipid AMG-PC on mast cells are similar to that of the ether lipid AMG but different from that of the analogue hexadecylphosphocholine

    DEFF Research Database (Denmark)

    Grosman, Nina

    1991-01-01

    Farmakologi, ether phospholipid, hexacylphosphocholine, miltefosine, protein kinase C, AMG-PC(alkyl-methyl-glycero-phosphocholine), Histamine release, mast cell......Farmakologi, ether phospholipid, hexacylphosphocholine, miltefosine, protein kinase C, AMG-PC(alkyl-methyl-glycero-phosphocholine), Histamine release, mast cell...

  20. Development and evaluation of the improved iron chelating agents EHPG, HBED and their dimethyl esters.

    Science.gov (United States)

    Hershko, C; Grady, R W; Link, G

    1984-01-01

    The phenolic EDTA analogues ethylenediamine-N,N'-bis-(2- hydroxyphenylglycine ) ( EHPG ), N,N'-bis(2-hydroxybenzyl)-ethylenediamine diacetic acid ( HBED ), and their respective dimethyl esters ( dimethylEHPG and dimethylHBED ) were studied in hypertransfused rats. Radioiron bound to these compounds was cleared mainly by the liver and excreted in the bile. After a single 40 mg i.m. injection, the percentage of radioiron removed from 59Fe-ferritin-labelled hepatocytes and excreted in the bile was 4% in untreated controls, 24% for desferral , 42% for dimethylEHPG , 58% for EHPG , 63% for HBED , and 80% for dimethylHBED . DimethylHBED combines oral effectiveness with superior chelating ability, selective hepatocellular action, and low apparent toxicity. It may represent a significant advance in the development of new iron chelating drugs.

  1. Review on Modification of Sulfonated Poly (-ether-ether-ketone Membranes Used as Proton Exchange Membranes

    Directory of Open Access Journals (Sweden)

    Xiaomin GAO

    2015-11-01

    Full Text Available The proton exchange membrane fuel cell (PEMFC is a type of modern power, but the traditional proton exchange membranes (PEM of PEMFC are limited by high methanol permeability and water uptake. Poly-ether-ether-ketone (PEEK is a widely used thermoplastic with good cost-effective property. Sulfonated poly (-ether-ether-ketone (SPEEK has high electric conductivity and low methanol permeability, as well as comprehensive property, which is expected to be used as PEMs. However, the proton exchange ability, methanol resistance, mechanical property and thermal stability of SPEEK are closely related to the degree of sulfonation (DS of SPEEK membranes. Additionally, the proton conductivity, methanol permeability, and stability of SPEEK membranes applied in various conditions need to be further improved. In this paper, the research into modification of SPEEK membranes made by SPEEK and other polymers, inorganic materials are introduced. The properties and modification situation of the SPEEK and the composite membranes, as well as the advantages and disadvantages of membranes prepared by different materials are summarized. From the results we know that, the methanol permeability of SPEEK/PES-C membranes is within the order of magnitude, 10-7cm2/s. The proton conductivity of the SPPESK/SPEEK blend membrane reaches 0.212 S cm-1 at 80 °C. The cross-linked SPEEK membranes have raised thermal and dimensional stability. The non-solvent caused aggregation of the SPEEK ionomers. The proton conductivity of SPEEK/50%BMIMPF6/4.6PA membrane maintains stable as 2.0 x 10-2S cm-1 after 600 h at 160 °C. Incorporation of aligned CNT into SPEEK increases the proton conductivity and reduces the methanol permeability of the composite membranes. The PANI improves the hydrothermal stability. More proton transfer sites lead to a more compact structure in the composite membranes. According to the results, the proton exchange capacity, water uptake, and conductivity of

  2. N-heterocyclic carbene catalyzed synthesis of dimethyl carbonate via transesterification of ethylene carbonate with methanol

    Directory of Open Access Journals (Sweden)

    Guang-Fen Du

    2015-01-01

    Full Text Available An organocatalytic protocol for the synthesis of dimethyl carbonate has been developed. Under the catalysis of 5 mol% N-heterocyclic carbenes, ethylene carbonate undergoes transesterification reaction with methanol under very mild reaction conditions, producing dimethyl carbonate with high efficiency. Furthermore, this N-heterocyclic carbene promoted transesterification can be scaled-up easily without lose of the conversion of dimethyl carbonate.

  3. Cystine accumulation and clearance by normal and cystinotic leukocytes exposed to cystine dimethyl ester.

    OpenAIRE

    Steinherz, R; Tietze, F.; Gahl, W A; Triche, T J; Chiang, H.; Modesti, A.; Schulman, J D

    1982-01-01

    Upon exposure to 0.25 mM cystine dimethyl ester, normal and cystinotic leukocytes accumulate substantially more intracellular cystine than is present endogenously in cystinotic cells. Leukocytes loaded by exposure to cystine dimethyl ester may have abnormally lucent and distended lysosomes, and the cystine is compartmentalized within the granular fraction of the cells. After the cells are exposed to cystine dimethyl ester, cystine clearance from normal leukocytes is much faster than from cyst...

  4. Detection of Oxidation of L-Cysteine by Dimethyl Sulfoxide in Aqueous Solutions by IR Spectroscopy

    Science.gov (United States)

    Papanyan, Z.; Markarian, S.

    2013-11-01

    We have used IR spectroscopy to study the reaction between L-cysteine and dimethyl sulfoxide in aqueous medium. We have found that reaction occurs with formation of an insoluble product, which we have identified. We show that oxidation of L-cysteine by dimethyl sulfoxide can occur at an appreciable rate under mild conditions, with formation of L-cystine, dimethyl sulfide, and water.

  5. Polybrominated diphenyl ethers and novel flame retardants

    DEFF Research Database (Denmark)

    Frederiksen, Marie; Vorkamp, Katrin; Nielsen, Jesper Bo

    ,4,6-tribromophenyl ether (TBP-DBPE) and dechlorane plus (DDC-CO) have been detected in the same dust samples previously analysed for PBDEs and are currently being analysed in the corresponding human milk samples. [1] Stapleon H.M., Eagle S., Sjödin A., Webster T.F. (2012). Serum PBDEs in a North Carolina Toddler......, the objectives were to study whether i) the associations observed for plasma also existed for human milk, ii) the PBDE profiles in dust and milk could provide insights into the bioavailability and bioaccumulation of individual congeners, iii) NFRs were measurable in human milk, and iv) infants were exposed...... to significant amounts of NFRs via breast feeding. PBDEs were detected in all of the 40 milk samples analysed in this study. ΣPBDEtri-hepta ranged from 0.98-45.8 ng/g lw, with a median of 2.26 ng/g lw. The main congener in milk was BDE-153, accounting for 35% of ΣPBDEtri-hepta. This is much higher than in dust...

  6. Molecular Design of Crown Ethers.22.Synthesis of Benzocrown Ether Derivatives and Their Solvent Extraction with Univalent/Bivalent Metal Picrates

    Institute of Scientific and Technical Information of China (English)

    YANG,Ying-Wei(杨英威); LI,Chun-Ju(李春举); ZHANG,Heng-Yi(张衡益); LIU,Yu(刘育)

    2004-01-01

    Three novel benzocrown ether derivatives have been synthesized and their cation binding behavior with uniand bi-valent metal ions was evaluated by the solvent extraction of aqueous metal picrates. The obtained results indicate that the size-fit of crown ether and metal cation, and electron effect of the side arm attached to benzocrown ethers affect their cation binding ability and selectivity.

  7. The Effects of Sulfonated Poly(ether ether ketone Ion Exchange Preparation Conditions on Membrane Properties

    Directory of Open Access Journals (Sweden)

    Rebecca S. L. Yee

    2013-08-01

    Full Text Available A low cost cation exchange membrane to be used in a specific bioelectrochemical system has been developed using poly(ether ether ketone (PEEK. This material is presented as an alternative to current commercial ion exchange membranes that have been primarily designed for fuel cell applications. To increase the hydrophilicity and ion transport of the PEEK material, charged groups are introduced through sulfonation. The effect of sulfonation and casting conditions on membrane performance has been systematically determined by producing a series of membranes synthesized over an array of reaction and casting conditions. Optimal reaction and casting conditions for producing SPEEK ion exchange membranes with appropriate performance characteristics have been established by this uniquely systematic experimental series. Membrane materials were characterized by ion exchange capacity, water uptake, swelling, potential difference and NMR analysis. Testing this extensive membranes series established that the most appropriate sulfonation conditions were 60 °C for 6 h. For mechanical stability and ease of handling, SPEEK membranes cast from solvent casting concentrations of 15%–25% with a resulting thickness of 30–50 µm were also found to be most suitable from the series of tested casting conditions. Drying conditions did not have any apparent impact on the measured parameters in this study. The conductivity of SPEEK membranes was found to be in the range of 10−3 S cm−1, which is suitable for use as a low cost membrane in the intended bioelectrochemical systems.

  8. Evaluation of workers exposed to ethylene glycol monomethyl ether and ethylene glycol monomethyl ether acetate.

    Science.gov (United States)

    Park, Jiyoung; Yoon, Chungsik; Byun, Hyaejeong; Kim, Yangho; Park, Donguk; Ha, Kwonchul; Lee, Sang man; Park, Sungki; Chung, Eunkyo

    2012-01-01

    Ethylene glycol monomethyl ether (EGME) and ethylene glycol monomethyl ether acetate (EGMEA) are widely used in industries as solvents for coatings, paint and ink, but exposure data are limited because they are minor components out of mixed solvents, as well as because of inconsistency in desorption solvent use. The objective of this study was to investigate the worker exposure profile of EGME and EGMEA. Our study investigated 27 workplaces from June to September 2008 and detected EGME and EGMEA in 20 and 13, respectively. Both personal and area sampling were conducted using a charcoal tube to collect EGME and EGMEA. Gas chromatography with a flame ionization detector was used to analyze these compounds after desorption using a mixture of methylene chloride and methanol. The arithmetic mean concentrations of EGME and EGMEA during periods of full work shifts were 2.59 ppm and 0.33 ppm, respectively. The exposure levels were lower than the Korean Ministry of Labor (MOL) OEL (5 ppm) but higher than the ACGIH TLV (0.1 ppm). In general, the working environments were poor and required much improvement, including the use of personal protective equipment. Only 50% of the workplaces had local exhaust ventilation systems in operation. The average capture velocity of the operating local exhaust ventilation systems was 0.27 m/s, which did not meet the legal requirement of 0.5 m/s. Educating workers to clearly understand the handling and use of hazardous chemicals and improving working conditions are strongly suggested.

  9. Molecular sieve/sulfonated poly(ether ketone ether sulfone) composite membrane as proton exchange membrane

    Science.gov (United States)

    Changkhamchom, Sairung; Sirivat, Anuvat

    2012-02-01

    A proton exchange membrane (PEM) is an electrolyte membrane used in both polymer electrolyte membrane fuel cells (PEMFC) and direct methanol fuel cells (DMFCs). Currently, PEMs typically used for PEMFCs are mainly the commercially available Nafion^ membranes, which is high cost and loss of proton conductivity at elevated temperature. In this work, the Sulfonated poly(ether ketone ether sulfone), (S-PEKES), was synthesized by the nucleophilic aromatic substitution polycondensation between bisphenol S and 4,4'-dichlorobenzophenone, and followed by the sulfonation reaction with concentrated sulfuric acid. The molecular sieve was added in the S-PEKES matrix at various ratios to form composite membranes to be the candidate for PEM. Properties of both pure sulfonated polymer and composite membranes were compared with the commercial Nafion^ 117 membrane from Dupont. S-PEKES membranes cast from these materials were evaluated as a polymer electrolyte membrane for direct methanol fuel cells. The main properties investigated were the proton conductivity, methanol permeability, thermal, chemical, oxidative, and mechanical stabilities by using a LCR meter, Gas Chromatography, Thermogravimetric Analysis, Fourier Transform Infrared Spectroscopy, Fenton's reagent, and Universal Testing Machine. The addition of the molecular sieve helped to increase both the proton conductivity and the methanol stability. These composite membranes are shown as to be potential candidates for use as a Proton Exchange Membrane (PEM).

  10. UV-induced Self-initiated Graft Polymerization of Acrylamide onto Poly(ether ether ketone)

    Institute of Scientific and Technical Information of China (English)

    CHEN Rui-chao; SUN Hui; LI Ang; XU Guo-zhi

    2012-01-01

    Photo-grafting of hydrophilic monomer was used to enhance the hydrophilicity of poly(ether ether ketone)(PEEK) with the aim of extending its applications to biological fields.PEEK sheets were surface modified by grafting of acrylamide(AAm) with ultraviolet(UV) irradiation in the presence or absence of benzophenone(BP).The effects of BP,irradiation time and monomer concentration on the surface wettability of PEEK were investigated.Characterization of modified PEEK using scanning electron microscopy(SEM),energy-disperse spectrometer(EDS) and water contact angle measurements shows that AAm was successfully grafted on PEEK surface both in presence and absence of BP.With the increase in irradiation time and monomer concentration,contact angles decrease to as low as 30°,demonstrating a significant improvement of surface hydrophilicity.In agreement with the decrease in contact angle,under identical conditions,the nitrogen concentration increases,suggesting the increase in grafting degree of the grafting polymerization.This investigation demonstrates a self-initiation of PEEK due to its BP-like structure in the backbone of the polymer.Though the graft polymerization proceeds more readily in the presence of BP,the self-initiated graft polymerization is clearly observed.

  11. 2,5-Dimethyl-3-phenylsulfonyl-1-benzofuran

    Directory of Open Access Journals (Sweden)

    Uk Lee

    2008-05-01

    Full Text Available The title compound, C16H14O3S, was prepared by the oxidation of 2,5-dimethyl-3-phenylsulfanyl-1-benzofuran with 3-chloroperoxybenzoic acid. The phenyl ring makes a dihedral angle of 76.98 (9° with the plane of the benzofuran fragment. The crystal structure is stabilized by π–π interactions between furan and benzene rings of neighbouring molecules [centroid–centroid distance = 3.775 (4 Å]. In addition, the crystal structure exhibits intra- and intermolecular C—H...O interactions.

  12. Novel Reaction of Some Azoles with Dimethyl Sulfoxid

    Institute of Scientific and Technical Information of China (English)

    WANG,Bin; ZHU,An-Xiong; DONG,Heng-Shan

    2004-01-01

    @@ The compounds 4a~4j were prepared by 3a~3j which were prepared from 1a~1j through 2a~2j. The compounds 6a~6j were prepared by the reaction of the products of 4a~4j with dimethyl sulfoxid via Dimroth rearrangement.[1] The compounds ethyl 5-arylamino-1H-1,2,3-triazol-4-carbonates (5a~5d) and ethyl 2-methylthiamethylene-5-arylamino-2H-1,2,3-triazol-4-carbonates (6a~6j) are established by MS, IR, elemental analysis and 1H NMR spectral data. The route of syntheses is shown in Scheme 1.

  13. Adsorption of Dimethyl Methylphosphonate on MoO3

    DEFF Research Database (Denmark)

    Head, Ashley R.; Tsyshevsky, Roman; Trotochaud, Lena

    2016-01-01

    Dimethyl methylphosphonate (DMMP) is a common chemical warfare agent simulant and is widely used in adsorption studies. To further increase the understanding of DMMP interactions with metal oxides, ambient pressure X-ray photoelectron spectroscopy was used to study the adsorption of DMMP on MoO3......, including the effects of oxygen vacancies, surface hydroxyl groups, and adsorbed molecular water. Density functional theory calculations were used to aid in the interpretation of the APXPS results. An inherent lack of Lewis acid metal sites results in weak interactions of DMMP with MoO3. Adsorption...

  14. Indirect Electrochemical Oxidation of 4-Amino-dimethyl-aniline Hydrochloride

    Institute of Scientific and Technical Information of China (English)

    2006-01-01

    The indirect electrochemical oxidation of 4-amino-dimethyl-aniline hydrochloride containing wastewater generated from vanillin production is presented. Experiments were conducted at a constant current density of 30 mA/cm2 via a Ti/Ru-Ti-Sn ternary oxide coated anode and an undivided reactor. During the various stages of the electrolysis, parameters such as the values of chemical oxygen demand (COD) and total organic carbon (TOC) were determined in order to evaluate the feasibility of the electrochemical treatment. The energy consumption and the current efficiency during the electrolysis were calculated. The present study proves the effectiveness of the electrochemical treatment for wastewater resulted from vanillin production.

  15. EtherCAT bus application in CNC system%EtherCAT总线在数控系统中的应用

    Institute of Scientific and Technical Information of China (English)

    丁琳娜

    2012-01-01

    文章首先对应用EtherCAT的数控系统相关知识进行介绍,然后针对引入EtherCAT的数控系统的实现,提出了一种基于EtherCAT技术的实时通信及PC控制的可行系统方案,构建了EtherCAT主从站网络结构,并详细分析了EtherCAT主站与从站的软硬件设计.

  16. Biodegradation of ethyl t-butyl ether (ETBE), methyl t-butyl ether (MTBE) and t-amyl methyl ether (TAME) by Gordonia terrae.

    Science.gov (United States)

    Hernandez-Perez, G; Fayolle, F; Vandecasteele, J P

    2001-01-01

    Gordonia terrae strain IFP 2001 was selected from activated sludge for its capacity to grow on ethyl t-butyl ether (ETBE) as sole carbon and energy source. ETBE was stoichiometrically degraded to t-butyl alcohol (TBA) and the activity was inducible. A constitutive strain, G. terrae IFP 2007, derived from strain IFP 2001, was also selected. Methyl t-butyl ether (MTBE) and t-amyl methyl ether (TAME) were not used as carbon and energy sources by the two strains, but cometabolic degradation of MTBE and TAME was demonstrated, to TBA and t-amyl alcohol (TAA) respectively, in the presence of a carbon source such as ethanol. No two-carbon compound was detected during growth on ETBE, but formate was produced during cometabolic degradation of MTBE or TAME. A monooxygenase was involved in the degradation of ethers, because no degradation of ETBE was observed under anaerobic conditions and the presence of a cytochrome P-450 was demonstrated in G. terrae IFP 2001 after induction by cultivation on ETBE.

  17. Lithium solvation in dimethyl sulfoxide-acetonitrile mixtures

    Energy Technology Data Exchange (ETDEWEB)

    Semino, Rocío; Zaldívar, Gervasio; Calvo, Ernesto J. [Departamento de Química Inorgánica Analítica y Química-Física e INQUIMAE, Facultad de Ciencias Exactas y Naturales, Universidad de Buenos Aires, Ciudad Universitaria, Pabellón II, 1428 Buenos Aires (Argentina); Laria, Daniel, E-mail: dhlaria@cnea.gov.ar [Departamento de Química Inorgánica Analítica y Química-Física e INQUIMAE, Facultad de Ciencias Exactas y Naturales, Universidad de Buenos Aires, Ciudad Universitaria, Pabellón II, 1428 Buenos Aires (Argentina); Departamento de Física de la Materia Condensada, Comisión Nacional de Energía Atómica, Avenida Libertador 8250, 1429 Buenos Aires (Argentina)

    2014-12-07

    We present molecular dynamics simulation results pertaining to the solvation of Li{sup +} in dimethyl sulfoxide-acetonitrile binary mixtures. The results are potentially relevant in the design of Li-air batteries that rely on aprotic mixtures as solvent media. To analyze effects derived from differences in ionic size and charge sign, the solvation of Li{sup +} is compared to the ones observed for infinitely diluted K{sup +} and Cl{sup −} species, in similar solutions. At all compositions, the cations are preferentially solvated by dimethyl sulfoxide. Contrasting, the first solvation shell of Cl{sup −} shows a gradual modification in its composition, which varies linearly with the global concentrations of the two solvents in the mixtures. Moreover, the energetics of the solvation, described in terms of the corresponding solute-solvent coupling, presents a clear non-ideal concentration dependence. Similar nonlinear trends were found for the stabilization of different ionic species in solution, compared to the ones exhibited by their electrically neutral counterparts. These tendencies account for the characteristics of the free energy associated to the stabilization of Li{sup +}Cl{sup −}, contact-ion-pairs in these solutions. Ionic transport is also analyzed. Dynamical results show concentration trends similar to those recently obtained from direct experimental measurements.

  18. 40 CFR 721.8160 - Propanoic acid, 2,2-dimethyl-, ethenyl ester.

    Science.gov (United States)

    2010-07-01

    ... ester. 721.8160 Section 721.8160 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY (CONTINUED... Specific Chemical Substances § 721.8160 Propanoic acid, 2,2-dimethyl-, ethenyl ester. (a) Chemical... acid, 2,2-dimethyl-, ethenyl ester (PMN P-89-1058) is subject to reporting under this section for...

  19. 21 CFR 524.981d - Fluocinolone acetonide, dimethyl sulfoxide solution.

    Science.gov (United States)

    2010-04-01

    ... 21 Food and Drugs 6 2010-04-01 2010-04-01 false Fluocinolone acetonide, dimethyl sulfoxide solution. 524.981d Section 524.981d Food and Drugs FOOD AND DRUG ADMINISTRATION, DEPARTMENT OF HEALTH AND... NEW ANIMAL DRUGS § 524.981d Fluocinolone acetonide, dimethyl sulfoxide solution. (a)...

  20. 40 CFR 721.538 - Phenol, 4-(1,1-dimethyl- ethyl)-, homopolymer.

    Science.gov (United States)

    2010-07-01

    ... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Phenol, 4-(1,1-dimethyl- ethyl... Specific Chemical Substances § 721.538 Phenol, 4-(1,1-dimethyl- ethyl)-, homopolymer. (a) Chemical substance and significant new uses subject to reporting. (1) The chemical substance identified as phenol,...

  1. Research on the Stability of Dimethyl Hydroxylamine-methyl Hydrazinein Nitric Acid Medium

    Institute of Scientific and Technical Information of China (English)

    2002-01-01

    By the means of the comparison of the extraction of PU(Ⅲ) and plutonium in nitric acid mediumcontaining dimethyl hydroxylamine-methyl hydrazine and the analysis of the percent content of PU(Ⅳ) inthe system, the stability of dimethyl hydroxylamine-methyl hydrazine in nitric acid medium is

  2. Efficient and Simple Synthesis of 6-Aryl-1,4-dimethyl-9H-carbazoles

    Directory of Open Access Journals (Sweden)

    Sylvain Rault

    2008-06-01

    Full Text Available A synthetic method for the preparation of 6-aryl-1,4-dimethyl-9H-carbazoles involving a palladium catalyzed coupling reaction of 1,4-dimethyl-9H-carbazole-6-boronic acids and (heteroaryl halides is described.

  3. Crystal structures of bis[2-(diphenylphosphinothioylphenyl] ether and bis{2-[diphenyl(selanylidenephosphanyl]phenyl} ether

    Directory of Open Access Journals (Sweden)

    Daron E. Janzen

    2014-12-01

    Full Text Available The title compounds, C36H28OP2S2, (1, and C36H28OP2Se2, (2, exhibit remarkably similar structures although they are not isomorphous. The whole molecule of compound (2 is generated by twofold symmetry, with the ether O atom located on the twofold axis. Both compounds have intramolecular π–π interactions between terminal phenyl rings with centroid–centroid distances of 3.6214 (16 and 3.8027 (14 Å in (1 and (2, respectively. In the crystal of (1, short C—H...S hydrogen bonds link the molecules, forming chains along [001], while in (2 there are no analogous C—H...Se interactions present.

  4. Stress shielding and fatigue limits of poly-ether-ether-ketone dental implants.

    Science.gov (United States)

    Lee, Woo-Taek; Koak, Jai-Young; Lim, Young-Jun; Kim, Seong-Kyun; Kwon, Ho-Beom; Kim, Myung-Joo

    2012-05-01

    The poly-ether-ether-ketone (PEEK) polymer is of great interest as an alternative to titanium in orthopedics because of its biocompatibility and low elastic modulus. This study evaluated the fatigue limits of PEEK and the effects of the low elastic modulus PEEK in relation to existing dental implants. Compressive loading tests were performed with glass fiber-reinforced PEEK (GFR-PEEK), carbon fiber-reinforced PEEK (CFR-PEEK), and titanium rods. Among these tests, GFR-PEEK fatigue tests were performed according to ISO 14801. For the finite element analysis, three-dimensional models of dental implants and bone were constructed. The implants in the test groups were coated with a 0.5-mm thick and 5-mm long PEEK layer on the upper intrabony area. The strain energy densities (SED) were calculated, and the bone resorption was predicted. The fatigue limits of GFR-PEEK were 310 N and were higher than the static compressive strength of GFR-PEEK. The bone around PEEK-coated implants showed higher levels of SED than the bone in direct contact with the implants, and the wider diameter and stiffer implants showed lower levels of SED. The compressive strength of the GFR-PEEK and CFR-PEEK implants ranged within the bite force of the anterior and posterior dentitions, respectively, and the PEEK implants showed adequate fatigue limits for replacing the anterior teeth. Dental implants with PEEK coatings and PEEK implants may reduce stress shielding effects. Dental implant application of PEEK polymer-fatigue limit and stress shielding. Copyright © 2012 Wiley Periodicals, Inc.

  5. Influence of Cellulose Ethers on Hydration Products of Portland Cement

    Institute of Scientific and Technical Information of China (English)

    MA Baoguo; OU Zhihua; JIAN Shouwei; XU Rulin

    2011-01-01

    Cellulose ethers are widely used to mortar formulations, and it is significant to understand the interaction between cellulose ethers and cement pastes. FT-IR spectra, thermal analysis and SEM are used to investigate hydration products in the cement pastes modified by HEMC and HPMC in this article. The results show that the hydration products in modified cement pastes were finally identical with those in the unmodified cement paste, but the major hydration products, such as CH (calcium hydroxide), ettringite and C-S-H, appeared later in the modified cement pastes than in the unmodified cement paste. The cellulose ethers decrease the outer products and increase inner products of C-S-H gels. Compared to unmodified cement pastes, no new products are found in the modified cement pastes in the present experiment. The HEMC and HPMC investigation shows almost the same influence on the hydration products of Portland cement.

  6. Synthesis and characterization of novel cellulose ether sulfates.

    Science.gov (United States)

    Rohowsky, Juta; Heise, Katja; Fischer, Steffen; Hettrich, Kay

    2016-05-20

    The synthesis and characterization of novel cellulose sulfate derivatives was reported. Various cellulose ethers were prepared in a homogeneous reaction with common sulfating agents. The received product possess different properties in dependence on the reaction conditions like sulfating agent, solvent, reaction time and reaction temperature. The cellulose ether sulfates are all soluble in water, they rheological behavior could be determined by viscosity measurements and the determination of the sulfur content by elemental analysis lead to a resulting degree of substitution ascribed to sulfate groups (DSSul) of the product. A wide range of products from DSSul 0.1 to DSSul 2.7 will be obtained. Furthermore the cellulose sulfate ethers could be characterized by Raman spectroscopy.

  7. Highly efficient palladium-catalyzed hydrostannation of ethyl ethynyl ether.

    Science.gov (United States)

    Andrews, Ian P; Kwon, Ohyun

    2008-12-08

    The palladium-catalyzed hydrostannation of acetylenes is widely exploited in organic synthesis as a means of forming vinyl stannanes for use in palladium-catalyzed cross-coupling reactions. Application of this methodology to ethyl ethynyl ether results in an enol ether that is challenging to isolate from the crude reaction mixture because of incompatibility with typical silica gel chromatography. Reported here is a highly efficient procedure for the palladium-catalyzed hydrostannation of ethyl ethynyl ether using 0.1% palladium(0) catalyst and 1.0 equiv of tributyltin hydride. The product obtained is a mixture of regioisomers that can be carried forward with exclusive reaction of the beta-isomer. This method is highly reproducible; relative to previously reported procedures, it is more economical and involves a more facile purification procedure.

  8. Synthesis of Flower-like Zinc Oxalate Microspheres in Ether-water Bilayer Refluxing Systems and Their Conversion to Zinc Oxide Microspheres

    Institute of Scientific and Technical Information of China (English)

    Liang Ni; Lei Wang; Bing Shao; Yinjue Wang; Wenli Zhang; Yong Jiang

    2011-01-01

    Flower-like zinc oxalate with a mean diameter of 50 μm was synthesized via the reaction of zinc acetate and dimethyl oxalate in ether-water bilayer refluxing systems at low temperature. Flower-like zinc oxalate microspheres can be further transformed into the similar morphology to zinc oxide by the decomposition of zinc oxalate at 500℃. Scanning electron microscopy (SEM), X-ray diffraction (XRD), thermogravimetric analysisdifferential scanning calorimetric (TG-DSC), energy dispersive X-ray spectrum (EDX) and Fourier transforminfrared spectroscopy (FT-IR) were used to characterize the structure features and chemical compositions of the as-synthesized products. The UV-Vis and photoluminescence spectrum of flower-like zinc oxide microspheres were studied. The experimental results showed that flower-like zinc oxalate microspheres may be self-assembled by the zinc oxalate flakes. The ether-water volume ratio of 4:1 and refluxing temperature of 40℃ wereconsidered to favor the preparation of flower-like zinc oxalate microspheres.

  9. EtherCAT被纳入EUROMAP协议规范

    Institute of Scientific and Technical Information of China (English)

    2010-01-01

    7月10日,欧洲的塑料和橡胶机械制造商协会批准在其应用中采用EtherCAT技术:EtherCAT被纳入EUROMAP75协议规范,成为其底层的通讯技术。在该协议规范的第三部分,描述有该实时以太网系统的实施。

  10. EtherCAT以太网现场总线

    Institute of Scientific and Technical Information of China (English)

    2006-01-01

    EtherCAT为现场总线系统树立了新的性能标准。它具备灵活的网络拓扑结构,系统配置简单,和现场总线系统一样操作直观简便。另外,由于EtherCAT实现成本低廉,因此使系统得以在过去无法应用现场总线网络的应用场合中选用现场总线。

  11. ELMO驱动器获得EtherCAT审批

    Institute of Scientific and Technical Information of China (English)

    2012-01-01

    ELMO公司宣布其Gold伺服驱动器已通过严格的EtherCAT一致性测试,使得ELMO成为仅有的通过测试的六家公司之一。ELMO投入了大量的时间、财力和技术来遵守行业协议,如EtherCAT协议,以及诸如Safety和EMC这样的标准。ELMO认为,遵守协议是强制性的,以确保任何工业设备的可靠运行。

  12. Enzymatic network for production of ether amines from alcohols

    DEFF Research Database (Denmark)

    Palacio, Cyntia M.; Crismaru, Ciprian G.; Bartsch, Sebastian

    2016-01-01

    of the desired ether amines from the corresponding ether alcohols with inorganic ammonium as the only additional substrate. To examine conversion, individual and overall reaction equilibria were established. Using these data, it was found that the experimentally observed conversions of up to 60% observed...... for reactions containing 10mM alcohol and up to 280mM ammonia corresponded well to predicted conversions. The results indicate that efficient amination can be driven by high concentrations of ammonia and may require improving enzyme robustness for scale-up....

  13. Synthesis and biophysical characterization of chlorambucil anticancer ether lipid prodrugs.

    Science.gov (United States)

    Pedersen, Palle J; Christensen, Mikkel S; Ruysschaert, Tristan; Linderoth, Lars; Andresen, Thomas L; Melander, Fredrik; Mouritsen, Ole G; Madsen, Robert; Clausen, Mads H

    2009-05-28

    The synthesis and biophysical characterization of four prodrug ether phospholipid conjugates are described. The lipids are prepared from the anticancer drug chlorambucil and have C16 and C18 ether chains with phosphatidylcholine or phosphatidylglycerol headgroups. All four prodrugs have the ability to form unilamellar liposomes (86-125 nm) and are hydrolyzed by phospholipase A(2), resulting in chlorambucil release. Liposomal formulations of prodrug lipids displayed cytotoxicity toward HT-29, MT-3, and ES-2 cancer cell lines in the presence of phospholipase A(2), with IC(50) values in the 8-36 microM range.

  14. Synthesis and Biophysical Characterization of Chlorambucil Anticancer Ether Lipid Prodrugs

    DEFF Research Database (Denmark)

    Pedersen, Palle Jacob; Christensen, Mikkel Stochkendahl; Ruysschaert, Tristan

    2009-01-01

    The synthesis and biophysical characterization of four prodrug ether phospholipid conjugates are described. The lipids are prepared from the anticancer drug chlorambucil and have C16 and C18 ether chains with phosphatidylcholine or phosphatidylglycerol headgroups. All four prodrugs have the ability...... to form unilamellar liposomes (86-125 nm) and are hydrolyzed by phospholipase A2, resulting in chlorambucil release. Liposomal formulations of prodrug lipids displayed cytotoxicity toward HT-29, MT-3, and ES-2 cancer cell lines in the presence of phospholipase A2, with IC50 values in the 8-36 μM range....

  15. Diphytanyl and dibiphytanyl glycerol ether lipids of methanogenic archaebacteria

    Energy Technology Data Exchange (ETDEWEB)

    Tornabene, T.G. (Colorado State Univ., Fort Collins); Langworthy, T.A.

    1979-01-05

    The lipids of nine different methanogenic bacterial strains are comprised of diphytanyl glycerol diethers, previously known only in extremely halophilic bacteria, as well as dibiphytanyl diglycerol tetraethers, known formerly only in the extremely thermoacidophilic bacteria Thermoplasma and Sulfolobus. Of the methanogens examined from four representative taxonomic groups, Methanobacterium and Methanospirillum contained both types of isopranyl ethers in nearly equal proportions, whereas the coccal forms, Methanosarcina and Methanococcus, possessed diphytanyl glycerol diethers, but with only a trace of or no dibiphytanyl diglycerol tetraethers. The occurrence of both types of isopranyl glycerol ethers in methanogenic bacteria supports the proposal that they have a close genealogical relationship to the extremely halophilic and thermoacidophilic bacteria.

  16. Environmental analysis of higher brominated diphenyl ethers and decabromodiphenyl ethane.

    Science.gov (United States)

    Kierkegaard, Amelie; Sellström, Ulla; McLachlan, Michael S

    2009-01-16

    Methods for environmental analysis of higher brominated diphenyl ethers (PBDEs), in particular decabromodiphenyl ether (BDE209), and the recently discovered environmental contaminant decabromodiphenyl ethane (deBDethane) are reviewed. The extensive literature on analysis of BDE209 has identified several critical issues, including contamination of the sample, degradation of the analyte during sample preparation and GC analysis, and the selection of appropriate detection methods and surrogate standards. The limited experience with the analysis of deBDethane suggests that there are many commonalities with BDE209. The experience garnered from the analysis of BDE209 over the last 15 years will greatly facilitate progress in the analysis of deBDethane.

  17. IRIS Toxicological Review of Ethyl Tertiary Butyl Ether (ETBE) ...

    Science.gov (United States)

    The IRIS Toxicological Review of Ethyl Tertiary Butyl Ether (ETBE) was released for external peer review in April 2017. EPA’s Science Advisory Board’s (SAB) Chemical Assessment Advisory Committee (CAAC) will conduct a peer review of the scientific basis supporting the ETBE assessment and release a final report of their review. Information regarding the peer review can be found on the SAB website. EPA is conducting an Integrated Risk Information System (IRIS) health assessment for Ethyl Tertiary Butyl Ether (ETBE). The outcome of this project is a Toxicological Review and IRIS Summary for ETBE that will be entered into the IRIS database.

  18. Acid Catalyzed Condensation of Phenylethanal Enol or Thiol Enol Ether to 2-Phenylnaphthalene

    Institute of Scientific and Technical Information of China (English)

    CHANG, Yu-An

    2007-01-01

    Treatment of enol ether or thiol enol ether of phenylethanals with sulfuric or polyphosphoric acid in toluene or xylene gave 2-phenylnaphthalene in good yield. More importantly, a one-pot reaction has been developed.

  19. 76 FR 7703 - 1,4-Benzenedicarboxylic Acid, Dimethyl Ester, Polymer With 1,4-Butanediol, Adipic Acid, and...

    Science.gov (United States)

    2011-02-11

    ... AGENCY 40 CFR Part 180 1,4-Benzenedicarboxylic Acid, Dimethyl Ester, Polymer With 1,4- Butanediol, Adipic... from the requirement of a tolerance for residues of 1,4-benzenedicarboxylic acid, dimethyl ester... residues of 1,4-benzenedicarboxylic acid, dimethyl ester, polymer with 1,4-butanediol, adipic acid,...

  20. 40 CFR 721.10056 - Benzenemethanaminium, N-(3-aminopropyl)-N,N-dimethyl-, N-soya acyl derivs., chlorides.

    Science.gov (United States)

    2010-07-01

    ...)-N,N-dimethyl-, N-soya acyl derivs., chlorides. 721.10056 Section 721.10056 Protection of Environment...-aminopropyl)-N,N-dimethyl-, N-soya acyl derivs., chlorides. (a) Chemical substance and significant new uses...-dimethyl-, N-soya acyl derivs., chlorides (PMN P-03-47; CAS No. 90194-13-1) is subject to reporting under...