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Royal Society of Chemistry, Environmental Science: Processes & Impacts, 3(22), p. 606-616, 2020

DOI: 10.1039/c9em00557a

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Reduction of 1,2,3-trichloropropane (TCP): pathways and mechanisms from computational chemistry calculations

Journal article published in 2020 by Tifany L. Torralba-Sanchez ORCID, Eric J. Bylaska ORCID, Alexandra J. Salter-Blanc ORCID, Douglas E. Meisenheimer ORCID, Molly A. Lyon, Paul G. Tratnyek ORCID
This paper was not found in any repository, but could be made available legally by the author.
This paper was not found in any repository, but could be made available legally by the author.

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Abstract

Lesser halogenated halocarbons such as 1,2,3-trichloropropane (TCP) are persistent under most conditions, but reductive beta-elimination favors complete dechlorination by hydrogenolysis of the allyl chloride intermediate.