Acetone → Phenol

HRID 141814Notes

Reaction equation

HRID 141814 reaction equation
[CH3:1][CH:2]([CH3:3])[c:4]1[cH:5][cH:6][cH:7][cH:8][cH:9]1.[CH3:21][C:22](=[O:23])[CH3:24].[O-:10][OH:11].[c:12]1([CH:18]([CH3:19])[CH3:20])[cH:13][cH:14][cH:15][cH:16][cH:17]1>>[c:12]1([CH:18]([CH3:19])[CH3:20])[cH:13][cH:14][cH:15][cH:16][cH:17]1.[c:4]1([OH:10])[cH:5][cH:6][cH:7][cH:8][cH:9]1

Participants

5

Reactant 3

HCID 180AcetoneHCID 7406Cumene2×HCID 18500Perhydroxyl radical

Product 2

HCID 996PhenolHCID 7406Cumene

Sources & evidence

ORD record
ord-6997c5ae9de74732a2348acb0ad2494b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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