Ethanol → 4-Amino-5-hydroxy-2-methylbenzonitrile

Reaction equation

[CH3:14][CH2:15][O:16][C:17]([CH3:18])=[O:19].[CH3:20][CH2:21][OH:22].[OH:1][c:2]1[c:3]([N+:11]([O-:12])=[O:13])[cH:4][c:5]([CH3:10])[c:6]([C:7]#[N:8])[cH:9]1>>[OH:1][c:2]1[c:3]([NH2:11])[cH:4][c:5]([CH3:10])[c:6]([C:7]#[N:8])[cH:9]1

Participants

Reactant 3

HCID 702Ethanol

HCID 8857Ethyl Acetate

HCID 594441745-Hydroxy-2-methyl-4-nitrobenzonitrile

Product 1

HCID 552844024-Amino-5-hydroxy-2-methylbenzonitrile

Sources & evidence

ORD record: ord-63be1c09659940af9897524b1debb0bd
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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