4.6 Article

Photo-oxidation of ethyl pyruvate initiated by chlorine atoms. Kinetics and reaction mechanism

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ELSEVIER SCIENCE SA
DOI: 10.1016/j.jphotochem.2023.114655

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Atmospheric chemistry; Rate coefficient; Degradation products; Reaction mechanism; Infrared spectroscopy

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Ethyl pyruvate, a bifunctional aliphatic ester derived from pyruvic acid, is widely used in industries such as pharmaceuticals, food, agrochemicals, and materials, which has a significant impact on the atmosphere. The reaction kinetics of ethyl pyruvate with chlorine atoms at 298 K and atmospheric pressure were determined, and a rate coefficient of (3.8±0.6) x 10-12 cm3 molec-1 s-1 was obtained. Several degradation products were identified, and a degradation mechanism was proposed based on these products and computational studies.
Ethyl pyruvate is a bifunctional aliphatic ester derived from pyruvic acid. It is widely used in massive industries such as pharmaceuticals, food, agrochemicals, and materials, implyin g an important injection into the atmo-sphere. The kinetic parameters of the reaction of ethyl pyruvate with chlorine atoms at 298 K and atmospheric pressure were determined employing the Relative Method. A rate coefficient ofkEPv= (3.8 & PLUSMN; 0.6) x 10 � 12cm3 molec � 1 s � 1 was determined . In addition, the followin g degradation products were identified: carbon monoxide, carbon dioxide, formic, acetic, and pyruvic acids, as wel l as a new tricarboxylic compound. Based on these products, and with the support of computational studies, a degradation mechanism is proposed.

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