Toluene → 3-(1,3,5-Trimethyl-1H-pyrazol-4-yl)-propionaldehyde
Reaction equation
[CH2:17]([Al+:18][CH2:19][CH:20]([CH3:21])[CH3:22])[CH:23]([CH3:24])[CH3:25].[CH2:1]([O:3][C:4](=[O:2])[CH2:5][CH2:6][c:7]1[c:8]([CH3:14])[n:9][n:10]([CH3:13])[c:11]1[CH3:12])[CH3:15].[CH3:31][c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1.[H-:16].[O:26]1[CH2:27][CH2:28][CH2:29][CH2:30]1>>[O:3]=[CH:4][CH2:5][CH2:6][c:7]1[c:8]([CH3:14])[n:9][n:10]([CH3:13])[c:11]1[CH3:12]Participants
6
Sources & evidence
- ORD record
- ord-94c7525d96d5414cb4ba611fd8175d35
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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