1-Chloro-4-isocyanato-2-(trifluoromethyl) benzene → HCID 59725903, compound
Reaction equation
[CH3:1][NH:2][C:3](=[O:4])[c:5]1[cH:6][c:7]2[cH:8][cH:9][n:10](-[c:14]3[cH:15][cH:16][c:17]([NH2:20])[cH:18][cH:19]3)[c:11]2[cH:12][cH:13]1.[Cl:21][c:22]1[c:23]([C:31]([F:32])([F:33])[F:34])[cH:24][c:25]([N:28]=[C:29]=[O:30])[cH:26][cH:27]1>>[CH3:1][NH:2][C:3](=[O:4])[c:5]1[cH:6][c:7]2[cH:8][cH:9][n:10](-[c:14]3[cH:15][cH:16][c:17]([NH:20][C:29]([NH:28][c:25]4[cH:24][c:23]([C:31]([F:32])([F:33])[F:34])[c:22]([Cl:21])[cH:27][cH:26]4)=[O:30])[cH:18][cH:19]3)[c:11]2[cH:12][cH:13]1Participants
3
Sources & evidence
- ORD record
- ord-b6fda8ea781147088dcd30844c5ee704
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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