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Full-Text Articles in Physical Sciences and Mathematics

Gas Phase Reactions Of Cyclopentadiene With Ch And Oh Radicals, Kacee Lynn Caster Jan 2021

Gas Phase Reactions Of Cyclopentadiene With Ch And Oh Radicals, Kacee Lynn Caster

Graduate Theses, Dissertations, and Problem Reports

The formation of polycyclic aromatic hydrocarbons (PAHs) and carbon-based nanoparticles in combustion environments is driven by the pyrolysis and oxidation of abundant fuel molecules. The subsequent growth of these pyrolytic byproducts is then propagated by reactions with small free radical species like OH, CH, O atoms, and C2H. Cyclopentadiene (C5H6) is a significant five-member combustion intermediate that has been detected in many high temperature reactions, such as in the pyrolysis of jet fuels like JP-10. Experimental and theoretical investigations in the reactions of cyclopentadiene with these small free radical species are necessary towards understanding …


Oxidation Of Substituted Catechols At The Air-Water Interface: Production Of Carboxylic Acids, Quinones, And Polyphenols, Elizabeth A. Pillar, Marcelo I. Guzman Apr 2017

Oxidation Of Substituted Catechols At The Air-Water Interface: Production Of Carboxylic Acids, Quinones, And Polyphenols, Elizabeth A. Pillar, Marcelo I. Guzman

Chemistry Faculty Publications

Anthropogenic activities contribute benzene, toluene, and anisole to the environment, which in the atmosphere are converted into the respective phenols, cresols, and methoxyphenols by fast gas-phase reaction with hydroxyl radicals (HO(•)). Further processing of the latter species by HO(•) decreases their vapor pressure as a second hydroxyl group is incorporated to accelerate their oxidative aging at interfaces and in aqueous particles. This work shows how catechol, pyrogallol, 3-methylcatechol, 4-methylcatechol, and 3-methoxycatechol (all proxies for oxygenated aromatics derived from benzene, toluene, and anisole) react at the air-water interface with increasing O3(g) during τc ≈ 1 μs contact time and contrasts their …


Acid-Free Nitration Of Benzene And Toluene In Zeolite Nazsm-5, Scott Kirkby Jan 2013

Acid-Free Nitration Of Benzene And Toluene In Zeolite Nazsm-5, Scott Kirkby

Scott J. Kirkby

The syntheses of nitrobenzene and p-nitrotoluene directly from benzene, toluene, and NO2 within the pore network of the initially acid-free zeolite NaZSM-5 are reported for the first time. The active species , formed by the interaction of NO2 with the Na+ cations present on the internal surface, results in the acid-free electrophilic substitution of the aromatic ring. There are two distinct reservoirs for the reagents: one associated with close proximity to the cation sites and the other associated with the siliceous areas of the pore network. Up to 34% of the hydrocarbon and 70% of the available NO2 are reacted …


Electrooxidation Of Benzene To Benzoquinone In A Packed Bed Reactor, Xinsheng Zhang, Ping Ding, Yingchun Dai, Weikang Yuan Aug 1998

Electrooxidation Of Benzene To Benzoquinone In A Packed Bed Reactor, Xinsheng Zhang, Ping Ding, Yingchun Dai, Weikang Yuan

Journal of Electrochemistry

A packed electrode reactor was used to oxidize to benzoquinone. Anode bed of the reactor has a size of 10~30 mm×450 mm×50 mm(thickness×length×width),and was packed porous lead alloy. A dispersion of benzene in 1 mol/L aqueous sulfuric acid was passed through the reactor. Current efficiency for benzoquinone generation is 62.9% at optimal operating condition: velocity of electrolyte flow, 0.19 ms -1 ;current, 10 A; thickness of anode bed, 10 mm, and percentage of benzene, 24%.