Phenyl isocyanate → HCID 57505782, compound
Reaction equation
[CH3:18][CH2:19][N:20]([CH2:21][CH3:22])[CH2:23][CH3:24].[O:25]=[C:26]=[N:27][c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1.[O:34]1[CH2:35][CH2:36][CH2:37][CH2:38]1.[n:1]1[cH:2][cH:3][n:4]2[n:5][c:6]([O:10][c:11]3[c:12]([NH2:13])[cH:14][cH:15][cH:16][cH:17]3)[cH:7][cH:8][c:9]12>>[n:1]1[cH:2][cH:3][n:4]2[n:5][c:6]([O:10][c:11]3[c:12]([NH:13][C:26](=[O:25])[NH:27][c:28]4[cH:29][cH:30][cH:31][cH:32][cH:33]4)[cH:14][cH:15][cH:16][cH:17]3)[cH:7][cH:8][c:9]12Participants
5
Sources & evidence
- ORD record
- ord-768799071fe243af9638668a9c19c7e1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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