Toluene → HCID 13505096, compound
Reaction equation
[CH3:1][c:2]1[c:3]([N+:26]([O-:27])=[O:28])[cH:4][c:5]([CH3:25])[c:6]([O:9][c:10]2[cH:11][cH:12][c:13]([C:16]([c:17]3[cH:18][cH:19][c:20]([Cl:23])[cH:21][cH:22]3)=[O:24])[cH:14][cH:15]2)[c:7]1[Cl:8].[CH3:29][c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1.[CH3:40][CH2:41][O:42][C:43](=[O:44])[CH3:45].[CH3:46][CH2:47][CH2:48][CH2:49][CH2:50][CH3:51].[Cl:36][CH:37]([Cl:38])[Cl:39]>>[CH3:1][c:2]1[c:3]([NH2:26])[cH:4][c:5]([CH3:25])[c:6]([O:9][c:10]2[cH:11][cH:12][c:13]([C:16]([c:17]3[cH:18][cH:19][c:20]([Cl:23])[cH:21][cH:22]3)=[O:24])[cH:14][cH:15]2)[c:7]1[Cl:8]Participants
6
Sources & evidence
- ORD record
- ord-247f61741e7c42869aa92938c742dc63
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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