Water → 2-Acetoxy-5-chlorobenzonitrile
Reaction equation
[CH3:17][C:18](=[O:19])[O:20][C:21](=[O:22])[CH3:23].[Cl:1][c:2]1[cH:3][cH:4][c:5]([OH:10])[c:6]([C:7]#[N:8])[cH:9]1.[OH2:16].[S:11](=[O:12])(=[O:13])([OH:14])[OH:15]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([O:10][C:18]([CH3:17])=[O:19])[c:6]([C:7]#[N:8])[cH:9]1Participants
5
Sources & evidence
- ORD record
- ord-84f1b20f8a2f4d25bce5e565113fbdbd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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