Benzyl isocyanate → HCID 162568437, compound
Reaction equation
[CH2:31]([c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1)[N:38]=[C:39]=[O:40].[CH3:1][O:2][C:3]([CH:4]([CH3:5])[c:6]1[cH:7][c:8](-[c:16]2[c:17]([CH2:26][NH:27][CH2:28][CH3:29])[cH:18][c:19]([C:22]([F:23])([F:24])[F:25])[cH:20][cH:21]2)[cH:9][c:10]([C:12]([F:13])([F:14])[F:15])[cH:11]1)=[O:30]>>[CH3:1][O:2][C:3]([CH:4]([CH3:5])[c:6]1[cH:7][c:8](-[c:16]2[c:17]([CH2:26][N:27]([CH2:28][CH3:29])[C:39]([NH:38][CH2:31][c:32]3[cH:33][cH:34][cH:35][cH:36][cH:37]3)=[O:40])[cH:18][c:19]([C:22]([F:23])([F:24])[F:25])[cH:20][cH:21]2)[cH:9][c:10]([C:12]([F:13])([F:14])[F:15])[cH:11]1)=[O:30]Participants
3
Sources & evidence
- ORD record
- ord-0045c1a7b60a473d8bb9b26ae8bc9026
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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