Benzene → 2,3-Dichloro-6-(trifluoromethyl)benzonitrile
Reaction equation
[Cl:1][c:2]1[c:3]([C:4](=[O:5])[NH2:6])[c:7]([C:12]([F:13])([F:14])[F:15])[cH:8][cH:9][c:10]1[Cl:11].[OH2:21].[P:16]([Cl:17])([Cl:18])([Cl:19])=[O:20].[cH:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1>>[Cl:1][c:2]1[c:3]([C:4]#[N:6])[c:7]([C:12]([F:13])([F:14])[F:15])[cH:8][cH:9][c:10]1[Cl:11]Participants
5
Sources & evidence
- ORD record
- ord-10350300a1584a8b85358c0ddb05524b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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