Hexachloroethane → 5-chloro-1-(2,4-difluoro-phenyl)-1H-[1,2,4]triazole
Reaction equation
[CH2:14]([Li:15])[CH2:16][CH2:17][CH3:18].[CH2:27]1[O:28][CH2:29][CH2:30][CH2:31]1.[Cl:19][C:20]([C:21]([Cl:22])([Cl:23])[Cl:24])([Cl:25])[Cl:26].[F:1][c:2]1[c:3](-[n:9]2[n:10][cH:11][n:12][cH:13]2)[cH:4][cH:5][c:6]([F:8])[cH:7]1>>[F:1][c:2]1[c:3](-[n:9]2[n:10][cH:11][n:12][c:13]2[Cl:19])[cH:4][cH:5][c:6]([F:8])[cH:7]1Participants
5
Sources & evidence
- ORD record
- ord-126005cac4bc47ed8c36966cbf3ac551
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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