Benzyl isocyanate → HCID 66607711, compound
Reaction equation
[CH2:27]([c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1)[N:34]=[C:35]=[O:36].[CH3:1][O:2][C:3]([CH2:4][c:5]1[cH:6][c:7](-[c:12]2[c:13]([CH2:22][NH:23][CH2:24][CH3:25])[cH:14][c:15]([C:18]([F:19])([F:20])[F:21])[cH:16][cH:17]2)[cH:8][c:9]([F:11])[cH:10]1)=[O:26]>>[CH3:1][O:2][C:3]([CH2:4][c:5]1[cH:6][c:7](-[c:12]2[c:13]([CH2:22][N:23]([CH2:24][CH3:25])[C:35]([NH:34][CH2:27][c:28]3[cH:29][cH:30][cH:31][cH:32][cH:33]3)=[O:36])[cH:14][c:15]([C:18]([F:19])([F:20])[F:21])[cH:16][cH:17]2)[cH:8][c:9]([F:11])[cH:10]1)=[O:26]Participants
3
Sources & evidence
- ORD record
- ord-403f9d178e99486399121e695a156f1f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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