Acetic Acid → 2-Hydroxy-3-methyl-5-nitro-benzonitrile

HRID 2142162Notes

Reaction equation

HRID 2142162 reaction equation
[C:1](#[N:2])[c:3]1[c:4]([OH:10])[c:5]([CH3:9])[cH:6][cH:7][cH:8]1.[CH3:16][C:17](=[O:18])[OH:19].[OH2:15].[OH:11][N+:12]([O-:13])=[O:14]>>[C:1](#[N:2])[c:3]1[c:4]([OH:10])[c:5]([CH3:9])[cH:6][c:7]([N+:12](=[O:11])[O-:13])[cH:8]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 944Nitric AcidHCID 962WaterHCID 143886552-Hydroxy-3-methylbenzonitrile

Product 1

HCID 212556572-Hydroxy-3-methyl-5-nitro-benzonitrile

Sources & evidence

ORD record
ord-dab06799832b43f497eed4a949eb7cb5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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