Hydrochloric Acid → 4-Chloromethyl-5-(4-methylphenyl)isoxazole
Reaction equation
[CH2:19]([Al+:20][CH2:21][CH:22]([CH3:23])[CH3:24])[CH:25]([CH3:26])[CH3:27].[CH3:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9]([C:13]([O:14][CH2:15][CH3:16])=[O:17])[cH:10][n:11][o:12]2)[cH:6][cH:7]1.[ClH:28].[H-:18].[O:29]1[CH2:30][CH2:31][CH2:32][CH2:33]1>>[CH3:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9]([CH2:13][Cl:28])[cH:10][n:11][o:12]2)[cH:6][cH:7]1Participants
6
Sources & evidence
- ORD record
- ord-1b733dc6a1254253b8b0ecb4020b6302
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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