Acetic Acid → 4-Hydroxy-3-methylbenzonitrile
Reaction equation
[CH3:14][C:15](=[O:16])[OH:17].[CH3:18][CH2:19][O:20][CH2:21][CH3:22].[Cl-:11].[OH:12][NH3+:13].[OH:1][c:2]1[c:3]([CH3:10])[cH:4][c:5]([CH:6]=[O:7])[cH:8][cH:9]1>>[OH:1][c:2]1[c:3]([CH3:10])[cH:4][c:5]([C:6]#[N:13])[cH:8][cH:9]1Participants
6
Sources & evidence
- ORD record
- ord-debab4e84a0a4b218e50a294efe9f0c4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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