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环状氢氟碳化物的大气化学:1-三氟甲基-1,2,2-三氟环丁烷与 Cl 原子、OH 自由基和 O 气相反应的动力学和机理。

Atmospheric chemistry of a cyclic hydro-fluoro-carbon: kinetics and mechanisms of gas-phase reactions of 1-trifluoromethyl-1,2,2-trifluorocyclobutane with Cl atoms, OH radicals, and O.

机构信息

Department of Chemistry, University of Copenhagen, Universitetsparken 5, Copenhagen DK-2100, Denmark.

出版信息

Phys Chem Chem Phys. 2019 Jan 17;21(3):1497-1505. doi: 10.1039/c8cp04228d.

Abstract

Long path length FTIR-smog chamber techniques were used to study the title reactions in 700 Torr of N2 or air diluent at 296 ± 2 K. Values of k(Cl + 1-trifluoromethyl-1,2,2-trifluorocyclobutane (TFMTFCB)) = (1.16 ± 0.21) × 10-14 and k(OH + TFMTFCB) = (3.51 ± 0.88) × 10-14 cm3 molecule-1 s-1 were measured. No reactivity of TFMTFCB towards ozone was observed. The atmospheric lifetime of TFMTFCB is determined by the reaction with OH and is approximately 330 days. The chlorine initiated oxidation gives C(O)F2 and CF3C(O)F as the dominant products in yields of (92 ± 2)% and (89 ± 2)%, respectively. The OH radical initiated oxidation gives C(O)F2 and CF3C(O)F as the dominant products in yields of (91 ± 6)% and (84 ± 4)%, respectively. The GWP100 was calculated as 44. The atmospheric chemistry of the title compound, a cyclic halogenated alkane, is discussed in the context of other halogenated cyclo-alkanes.

摘要

长光程傅里叶变换红外烟雾箱技术被用于在 700 托的 N2 或空气稀释剂中于 296 ± 2 K 下研究标题反应。Cl + 1-三氟甲基-1,2,2-三氟环丁烷(TFMTFCB)的反应速率常数 k 值为(1.16 ± 0.21)× 10-14,OH + TFMTFCB 的反应速率常数 k 值为(3.51 ± 0.88)× 10-14 cm3 分子-1 s-1。未观察到 TFMTFCB 与臭氧的反应活性。TFMTFCB 的大气寿命由其与 OH 的反应决定,约为 330 天。氯引发的氧化生成 C(O)F2 和 CF3C(O)F 作为主要产物,产率分别为(92 ± 2)%和(89 ± 2)%。OH 自由基引发的氧化生成 C(O)F2 和 CF3C(O)F 作为主要产物,产率分别为(91 ± 6)%和(84 ± 4)%。GWP100 计算值为 44。标题化合物是一种环状卤代烷烃,其大气化学性质在其他卤代环烷烃的背景下进行了讨论。

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