Benzyl isocyanate → HCID 66608024, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([CH:5]([CH3:6])[c:7]1[cH:8][c:9](-[c:15]2[c:16]([CH2:25][NH:26][CH2:27][CH3:28])[cH:17][c:18]([C:21]([F:22])([F:23])[F:24])[cH:19][cH:20]2)[c:10]([O:13][CH3:14])[cH:11][cH:12]1)=[O:29].[CH2:30]([c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1)[N:37]=[C:38]=[O:39]>>[CH2:1]([CH3:2])[O:3][C:4]([CH:5]([CH3:6])[c:7]1[cH:8][c:9](-[c:15]2[c:16]([CH2:25][N:26]([CH2:27][CH3:28])[C:38]([NH:37][CH2:30][c:31]3[cH:32][cH:33][cH:34][cH:35][cH:36]3)=[O:39])[cH:17][c:18]([C:21]([F:22])([F:23])[F:24])[cH:19][cH:20]2)[c:10]([O:13][CH3:14])[cH:11][cH:12]1)=[O:29]Participants
3
Sources & evidence
- ORD record
- ord-b6d0e5b32dfe428b9d87f51fc8307d8f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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