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Citation
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HERO ID
3120520
Reference Type
Journal Article
Title
Investigation of the Gas-Phase Photolysis and Temperature-Dependent OH Reaction Kinetics of 4-Hydroxy-2-butanone
Author(s)
Bouzidi, H; Aslan, L; El Dib, G; Coddeville, P; Fittschen, C; Tomas, A
Year
2015
Is Peer Reviewed?
1
Journal
Environmental Science & Technology
ISSN:
0013-936X
EISSN:
1520-5851
Volume
49
Issue
20
Page Numbers
12178-12186
Language
English
PMID
26418727
DOI
10.1021/acs.est.5b02721
Web of Science Id
WOS:000363348700023
Abstract
Hydroxyketones are key secondary reaction products in the atmospheric oxidation of volatile organic compounds (VOCs). The fate of these oxygenated VOCs is however poorly understood and scarcely taken into account in atmospheric chemistry modeling. In this work, a combined investigation of the photolysis and temperature-dependent OH radical reaction of 4-hydroxy-2-butanone (4H2B) is presented. The objective was to evaluate the importance of the photolysis process relative to OH oxidation in the atmospheric degradation of 4H2B. A photolysis lifetime of about 26 days was estimated with an effective quantum yield of 0.08. For the first time, the occurrence of a Norrish II mechanism was hypothesized following the observation of acetone among photolysis products. The OH reaction rate coefficient follows the Arrhenius trend (280-358 K) and could be modeled through the following expression: k4H2B(T) = (1.26 ± 0.40) × 10(-12) × exp((398 ± 87)/T) in cm(3) molecule(-1) s(-1). An atmospheric lifetime of 2.4 days regarding the OH + 4H2B reaction was evaluated, indicating that OH oxidation is by far the major degradation channel. The present work underlines the need for further studies on the atmospheric fate of oxygenated VOCs.
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