Ethanol → 3-Methyl-4-[2-(trifluoromethyl)phenyl]benzoic acid

HRID 697799

Reaction equation

HRID 697799 reaction equation
[CH3:1][c:2]1[c:3](-[c:12]2[c:13]([C:18]([F:19])([F:20])[F:21])[cH:14][cH:15][cH:16][cH:17]2)[cH:4][cH:5][c:6]([C:8](=[O:9])[O:10][CH3:11])[cH:7]1.[CH3:24][CH2:25][OH:26].[Na+:23].[OH-:22].[OH2:27]>>[CH3:1][c:2]1[c:3](-[c:12]2[c:13]([C:18]([F:19])([F:20])[F:21])[cH:14][cH:15][cH:16][cH:17]2)[cH:4][cH:5][c:6]([C:8](=[O:9])[OH:10])[cH:7]1

Participants

6

Reactant 5

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 59606539Methyl 2-methyl-2'-(trifluoromethyl)biphenyl-4-carboxylate

Product 1

HCID 219478123-Methyl-4-[2-(trifluoromethyl)phenyl]benzoic acid

Sources & evidence

ORD record
ord-18dceadfa5bc458e9bbe3ee10540a2b2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Linked notes

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