2-Nitrophenol → HCID 18521022, compound
Reaction equation
[CH3:21][CH:22]([CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH3:28])[OH:29].[N+:30]([c:31]1[cH:32][cH:33][cH:34][cH:35][c:36]1[OH:37])([O-:38])=[O:39].[OH:1][c:2]1[c:3]([N+:18](=[O:19])[O-:20])[cH:4][c:5](-[c:8]2[cH:9][cH:10][c:11]([C:14](=[O:15])[O:16][CH3:17])[cH:12][cH:13]2)[cH:6][cH:7]1>>[O:1]([c:2]1[c:3]([N+:18](=[O:19])[O-:20])[cH:4][c:5](-[c:8]2[cH:9][cH:10][c:11]([C:14](=[O:15])[O:16][CH3:17])[cH:12][cH:13]2)[cH:6][cH:7]1)[CH:22]([CH3:21])[CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH3:28]Participants
4
Sources & evidence
- ORD record
- ord-070e525dc7c74598bf6e5f8b6943783b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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