title: A multiple shock tube and chemical kinetic modeling study of diethyl ether pyrolysis and oxidation.
abstract: The pyrolysis and oxidation of diethyl ether (DEE) has been studied at pressures from 1 to 4 atm and temperatures of 900-1900 K behind reflected shock waves. A variety of spectroscopic diagnostics have been used, including time-resolved infrared absorption at 3.39 mum and time-resolved ultraviolet emission at 431 nm and absorption at 306.7 nm. In addition, a single-pulse shock tube was used to measure reactant, intermediate, and product species profiles by GC samplings at different reaction times varying from 1.2 to 1.8 ms. A detailed chemical kinetic model comprising 751 reactions involving 148 species was assembled and tested against the experiments with generally good agreement. In the early stages of reaction the unimolecular decomposition and hydrogen atom abstraction of DEE and the decomposition of the ethoxy radical have the largest influence. In separate experiments at 1.9 atm and 1340 K, it is shown that DEE inhibits the reactivity of an equimolar mixture of hydrogen and oxygen (1% of each).
authors.affiliation: Combustion Chemistry Centre, School of Chemistry, NUI Galway, Ireland. kenji.yasunaga@nuigalway.ie
authors.forename: K
authors.initials: K
authors.lastname: Yasunaga
authors.forename: F
authors.initials: F
authors.lastname: Gillespie
authors.forename: J M
authors.initials: JM
authors.lastname: Simmie
authors.forename: H J
authors.initials: HJ
authors.lastname: Curran
authors.forename: Y
authors.initials: Y
authors.lastname: Kuraguchi
authors.forename: H
authors.initials: H
authors.lastname: Hoshikawa
authors.forename: M
authors.initials: M
authors.lastname: Yamane
authors.forename: Y
authors.initials: Y
authors.lastname: Hidaka
mesh_terms: D000042:Absorption; D004986:Ether / Q000737:chemistry*; D006878:Hydroxides / Q000737:chemistry; D007700:Kinetics; D007834:Lasers; D008956:Models, Chemical; D010084:Oxidation-Reduction; D013055:Spectrophotometry, Infrared
chemical_list: D006878:Hydroxides; D004986:Ether; C031356:hydroxide ion