Acetic Acid → 2-(3-Amino-4-hydroxyphenyl)propanenitrile
Reaction equation
[CH3:32][C:33](=[O:34])[OH:35].[CH3:36][CH2:37][OH:38].[H:30][H:31].[N+:16]([O-:17])(=[O:18])[c:19]1[cH:20][c:21]([CH:26]([C:27]#[N:28])[CH3:29])[cH:22][cH:23][c:24]1[OH:25].[OH:12][N+:13](=[O:14])[O-:15].[OH:1][c:2]1[cH:3][cH:4][c:5]([CH:6]([CH3:7])[C:8]#[N:9])[cH:10][cH:11]1.[Pd:39]>>[NH2:16][c:19]1[cH:20][c:21]([CH:26]([C:27]#[N:28])[CH3:29])[cH:22][cH:23][c:24]1[OH:25]Participants
8
Sources & evidence
- ORD record
- ord-376d0102e08d4e5ab5b6fa562e371810
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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