Phenol → 2-Methyl-4-nitro-1-phenoxybenzene
Reaction equation
[C:19](=[O:20])([O-:21])[O-:22].[CH3:30][CH2:31][O:32][C:33]([CH3:34])=[O:35].[Cs+:23].[Cs+:24].[F:1][c:2]1[c:3]([CH3:11])[cH:4][c:5]([N+:8](=[O:9])[O-:10])[cH:6][cH:7]1.[O:25]=[CH:26][N:27]([CH3:28])[CH3:29].[OH:12][c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1>>[c:2]1([O:12][c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[c:3]([CH3:11])[cH:4][c:5]([N+:8](=[O:9])[O-:10])[cH:6][cH:7]1Participants
7
Sources & evidence
- ORD record
- ord-e5713d08a5884af3964819f4800a0295
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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