Water → 5-(3,5-Difluorobenzoyl)-2-fluorobenzonitrile
Reaction equation
[CH3:21][N+:22]1([O-:23])[CH2:24][CH2:25][O:26][CH2:27][CH2:28]1.[CH3:37][CH2:38][CH2:39][N+:40]([CH2:41][CH2:42][CH3:43])([CH2:44][CH2:45][CH3:46])[CH2:47][CH2:48][CH3:49].[Cl:29][CH2:30][Cl:31].[F:1][c:2]1[cH:3][c:4]([CH:9]([c:10]2[cH:11][cH:12][c:13]([F:18])[c:14]([C:15]#[N:16])[cH:17]2)[OH:19])[cH:5][c:6]([F:8])[cH:7]1.[O-:32][Ru:33](=[O:34])(=[O:35])=[O:36].[OH2:20]>>[F:1][c:2]1[cH:3][c:4]([C:9]([c:10]2[cH:11][cH:12][c:13]([F:18])[c:14]([C:15]#[N:16])[cH:17]2)=[O:19])[cH:5][c:6]([F:8])[cH:7]1Participants
7
Sources & evidence
- ORD record
- ord-81459fdd5ee445f68593505a3906e4c5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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