Kinetic and Mechanism of the Photo-Oxidation of 2-Methoxyethanol with Chlorine Atoms in the Troposphere
The rate coefficient for the reaction between 2-methoxyethanol (2ME, CH<sub>3</sub>OCH<sub>2</sub>CH<sub>2</sub>OH) and chlorine atoms in the gas phase has been determined for the first time by the relative method at 298 K and atmospheric pressure using infrared spectroscopy. This yielded a value of (1.4 ± 0.2) × 10<sup>-10</sup> cm<sup>3</sup> molecule<sup>-1</sup> s<sup>-1</sup>. A comparison of this value with that derived from the structure-activity relationship (SAR) shows good concordance, and a reactivity correlation analysis using the rate coefficients reported in the bibliography for similar compounds was also included. The degradation products initiated by the attack of chlorine atoms to the 2-methoxyethanol molecule were identified as 2-methoxyacetaldehyde, formic acid, methyl formate (41%), methyl 2-hydroxyacetate (2.5%), and 2-hydroxyethyl formate (20%). From these products and the kinetic analysis, the reaction mechanism was proposed. Finally, the environmental implications of 2-methoxyethanol emissions were analyzed, taking into account its reactivity with hydroxyl (HO<sup>•</sup>) radicals and chlorine atoms as well as its POCP values. The results showed that the lifetime of 2ME is controlled by its reactivity with HO<sup>•</sup> radicals.
Authors
- Lourdes Luz Varela Prieto (ORCID: https://orcid.org/0000-0001-6000-3113)
- Javier A. Barrera (ORCID: https://orcid.org/0000-0003-3722-9282)
- Fabio E. Malanca (ORCID: https://orcid.org/0000-0001-9289-5689)
- Jesús A. Vila (ORCID: https://orcid.org/0009-0005-4071-9006)
Institutions
- Universidad Nacional de Córdoba (AR)
- Instituto de Investigaciones en Ciencias de la Salud (AR)
Publication Details
- Journal
- The Journal of Physical Chemistry A
- Published
- 2025-10-09
- DOI
- https://doi.org/10.1021/acs.jpca.5c04720
- Primary Topic
- Atmospheric chemistry and aerosols
- Type
- article
- Field-Weighted Citation Impact
- 0.00