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Kinetics of the reactions of Cl atoms with 2-buten-1-ol, 2-methyl-2-propen-1-ol, and 3-methyl-2-buten-1-ol as a function of temperature
Authors:Diana Rodriguez  Ana Rodriguez  Amparo Soto  Alfonso Aranda  Yolanda Diaz-de-Mera  Alberto Notario
Institution:(1) Facultad de CC Medio Ambiente, Universidad de Castilla La Mancha, Avenida Carlos III, s/n, 45071 Toledo, Spain;(2) Facultad de CC Químicas, Universidad de Castilla La Mancha, Avenida Camilo José Cela, No. 10, 13071 Ciudad Real, Spain;(3) Instituto de Tecnologías Química y Medioambiental (ITQUIMA), Universidad de Castilla La Mancha, Avenida Camilo José Cela, s/n, 13071 Ciudad Real, Spain
Abstract:The reactions of three structurally similar unsaturated alcohols, 2-buten-1-ol (crotyl alcohol), 2-methyl-2-propen-1-ol (MPO221) and 3-methyl-2-buten-1-ol (MBO321) with Cl atoms, have been investigated for the first time, using a 400 l Teflon reaction chamber coupled with gas chromatograph-coupled with flame-ionization detection (GC-FID). The experiments were performed at atmospheric pressure and at temperatures between 255 and 298 K, in air or nitrogen as the bath gas. The obtained kinetic data were used to derive the Arrhenius expressions $$k_{{\text{MPO221}}}  = \left( {3.05 \pm 1.40} \right) \times 10^{ - 23} \exp {{\left( {8,760 \pm 1,279} \right)} \mathord{\left/ {\vphantom {{\left( {8,760 \pm 1,279} \right)} T}} \right. \kern-\nulldelimiterspace} T}$$, $$k_{{\text{crotyl}}}  = \left( {8.85 \pm 0.46} \right) \times 10^{ - 21} \exp {{\left( {7,240 \pm 1,455} \right)} \mathord{\left/ {\vphantom {{\left( {7,240 \pm 1,455} \right)} T}} \right. \kern-\nulldelimiterspace} T}$$, $$k_{{\text{MBO321}}}  = \left( {7.55 \pm 0.20} \right) \times 10^{ - 21} \exp {{\left( {7,361 \pm 735} \right)} \mathord{\left/ {\vphantom {{\left( {7,361 \pm 735} \right)} T}} \right. \kern-\nulldelimiterspace} T}$$ (in units of cm3 molecule−1 s−1). Finally, atmospheric lifetimes of those unsaturated alcohols with respect to OH, NO3, O3 and Cl have been calculated.
Keywords:Atmospheric chemistry  Chlorine atoms  Alcohols  Gas-phase reaction  Relative method  Temperature
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