Benzene → 1-(3-Methyl-1,3-butadienyl)-2-nitrobenzene
Reaction equation
[Br-:6].[N+:7](=[O:8])([O-:9])[c:10]1[c:11]([CH2:12][P+:13]([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)([c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[cH:32][cH:33][cH:34][cH:35]1.[Na+:37].[O:1]=[CH:2][C:3]([CH3:4])=[CH2:5].[OH-:36].[cH:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1>>[CH:2]([C:3]([CH3:4])=[CH2:5])=[CH:12][c:11]1[c:10]([N+:7](=[O:8])[O-:9])[cH:35][cH:34][cH:33][cH:32]1Participants
7
Sources & evidence
- ORD record
- ord-10589ef054034d15aac152c8e8fae6eb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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