Benzene → 5-(Bromomethyl)-2-chlorobenzonitrile
Reaction equation
[Br:11][N:12]1[C:13](=[O:14])[CH2:15][CH2:16][C:17]1=[O:18].[C:19]([O:20][O:21][C:22](=[O:23])[c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)(=[O:30])[c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1.[Cl:1][c:2]1[c:3]([C:4]#[N:5])[cH:6][c:7]([CH3:10])[cH:8][cH:9]1.[cH:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1>>[Cl:1][c:2]1[c:3]([C:4]#[N:5])[cH:6][c:7]([CH2:10][Br:11])[cH:8][cH:9]1Participants
5
Sources & evidence
- ORD record
- ord-9208245644824c0199fbf78fa4f03c2a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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