Benzene → 3-Chloro-4-(phenethyloxy)phenyl isocyanate
Reaction equation
[C:18]([O-:19])(=[O:20])[O-:21].[CH3:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[Cl:1][c:2]1[cH:3][c:4]([NH2:5])[cH:6][cH:7][c:8]1[O:9][CH2:10][CH2:11][c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1.[Cl:24][C:25](=[O:26])[Cl:27].[K+:22].[K+:23].[cH:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1>>[Cl:1][c:2]1[cH:3][c:4]([N:5]=[C:18]=[O:19])[cH:6][cH:7][c:8]1[O:9][CH2:10][CH2:11][c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1Participants
7
Sources & evidence
- ORD record
- ord-798ef7a799374dcc8cdaa0c229ee61b1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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