4-(Trifluoromethyl)benzyl isocyanate → HCID 69522762, compound
Reaction equation
[F:14][C:15]([c:16]1[cH:17][cH:18][c:19]([CH2:20][N:21]=[C:22]=[O:23])[cH:24][cH:25]1)([F:26])[F:27].[F:1][c:2]1[c:3]([NH2:13])[c:4]2[cH:5][cH:6][n:7][c:8]([CH3:12])[c:9]2[cH:10][cH:11]1>>[F:1][c:2]1[c:3]([NH:13][C:22]([NH:21][CH2:20][c:19]2[cH:18][cH:17][c:16]([C:15]([F:14])([F:26])[F:27])[cH:25][cH:24]2)=[O:23])[c:4]2[cH:5][cH:6][n:7][c:8]([CH3:12])[c:9]2[cH:10][cH:11]1Participants
3
Sources & evidence
- ORD record
- ord-e8e8f11b440d41f5a22c58b59f1b3d90
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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