Ethanol → 2-(4-Methylphenyl)benzoic acid

Reaction equation

[CH3:20][CH2:21][OH:22].[Na+:19].[OH-:18].[c:1]1([CH3:17])[cH:2][cH:3][c:4](-[c:7]2[c:8]([C:9](=[O:10])[O:11][CH3:12])[cH:13][cH:14][cH:15][cH:16]2)[cH:5][cH:6]1>>[c:1]1([CH3:17])[cH:2][cH:3][c:4](-[c:7]2[c:8]([C:9](=[O:10])[OH:11])[cH:13][cH:14][cH:15][cH:16]2)[cH:5][cH:6]1

Participants

Reactant 4

HCID 702Ethanol

HCID 923Sodium Ion

HCID 961Hydroxide

HCID 1393873(1,1'-Biphenyl)-2-carboxylic acid, 4'-methyl-, methyl ester

Product 1

HCID 815682-(4-Methylphenyl)benzoic acid

Sources & evidence

ORD record: ord-34da18040eb24af28d50ceec19d5195b
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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