Acetonitrile → 3-(difluoromethyl)-5-fluoro-1-methyl-1H-pyrazole-4-carboxylic acid
Reaction equation
[CH3:29][CH2:30][O:31][C:32](=[O:33])[CH3:34].[CH3:35][C:36]#[N:37].[F:6][c:7]1[c:8]([CH:16]=[O:17])[c:9]([CH:13]([F:14])[F:15])[n:10][n:11]1[CH3:12].[I+3:1]([OH:2])([O-:3])([O-:4])[O-:5].[O:18]=[Cr:19]([Cl:20])([O-:21])=[O:22].[nH+:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1>>[F:6][c:7]1[c:8]([C:16](=[O:17])[OH:18])[c:9]([CH:13]([F:14])[F:15])[n:10][n:11]1[CH3:12]Participants
7
Sources & evidence
- ORD record
- ord-d04212d5c9144304b8a5dbc5f6aa79e5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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