tert-Butanol → 4-nitro-1-phenyl-1H-Pyrazol-3-amine
Reaction equation
[CH2:47]1[O:48][CH2:49][CH2:50][O:51][CH2:52]1.[CH3:35][CH2:36][N:37]([CH2:38][CH3:39])[CH2:40][CH3:41].[CH3:42][C:43]([OH:44])([CH3:45])[CH3:46].[CH3:53][CH2:54][O:55][C:56](=[O:57])[CH3:58].[N+:1](=[O:2])([O-:3])[c:4]1[c:5]([C:15]([OH:16])=[O:17])[n:6][n:7](-[c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)[cH:8]1.[c:18]1([P:19]([c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)(=[O:28])[N:32]=[N+:20]=[N-:21])[cH:29][cH:30][cH:31][cH:33][cH:34]1>>[N+:1](=[O:2])([O-:3])[c:4]1[c:5]([NH2:32])[n:6][n:7](-[c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)[cH:8]1Participants
7
Sources & evidence
- ORD record
- ord-bd8b74a3c8d048809ae122c348dbaf1f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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