Dataset for machine-learning prediction of peracetic acid reaction rate constants with organic compounds
Published: 16 July 2026| Version 2 | DOI: 10.17632/3p8xghmds8.2
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Description
Curated dataset of 108 organic compounds with experimental second-order rate constants for their reactions with peracetic acid (PAA), and quantum-chemical descriptors supporting the associated manuscript.
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Oxidation Reaction