4-(Trifluoromethyl)benzyl isocyanate → HCID 69522683, compound
Reaction equation
[F:15][C:16]([c:17]1[cH:18][cH:19][c:20]([CH2:21][N:22]=[C:23]=[O:24])[cH:25][cH:26]1)([F:27])[F:28].[F:1][c:2]1[c:3]([NH2:14])[c:4]2[cH:5][c:6]([CH3:13])[n:7][cH:8][c:9]2[c:10]([F:12])[cH:11]1>>[F:1][c:2]1[c:3]([NH:14][C:23]([NH:22][CH2:21][c:20]2[cH:19][cH:18][c:17]([C:16]([F:15])([F:27])[F:28])[cH:26][cH:25]2)=[O:24])[c:4]2[cH:5][c:6]([CH3:13])[n:7][cH:8][c:9]2[c:10]([F:12])[cH:11]1Participants
3
Sources & evidence
- ORD record
- ord-abba0de6c798489d9a424879fae8ce04
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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