1-Chloro-4-isocyanato-2-(trifluoromethyl) benzene → HCID 57974612, compound
Reaction equation
[Cl:20][c:21]1[c:22]([C:30]([F:31])([F:32])[F:33])[cH:23][c:24]([N:27]=[C:28]=[O:29])[cH:25][cH:26]1.[NH2:1][c:2]1[cH:3][c:4]([CH3:19])[c:5]([O:6][c:7]2[c:8]([N+:14](=[O:15])[O-:16])[c:9]([NH2:13])[n:10][cH:11][cH:12]2)[cH:17][cH:18]1>>[NH:1]([c:2]1[cH:3][c:4]([CH3:19])[c:5]([O:6][c:7]2[c:8]([N+:14](=[O:15])[O-:16])[c:9]([NH2:13])[n:10][cH:11][cH:12]2)[cH:17][cH:18]1)[C:28]([NH:27][c:24]1[cH:23][c:22]([C:30]([F:31])([F:32])[F:33])[c:21]([Cl:20])[cH:26][cH:25]1)=[O:29]Participants
3
Sources & evidence
- ORD record
- ord-7298e19485c24489b0eff5493138def1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
Loading…