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Abstraction of an H atom from the propyl side chain by hydroperoxyl radicals (HO2) constitutes a central reaction in the low-temperature oxidation of n-propylbenzene (nPB). Herein, we calculate reaction rate constants for H abstraction from primary, secondary and benzylic sites in nPB. Rate of abstraction of a benzylic H atom dominates that of a secondary H atom with negligible abstraction of the...
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