Hydrochloric Acid → 3-[5-(4-Trifluoromethylphenyl)-4-isoxazolyl]propan-1-ol
Reaction equation
[CH2:23]([Al+:24][CH2:25][CH:26]([CH3:27])[CH3:28])[CH:29]([CH3:30])[CH3:31].[ClH:32].[F:1][C:2]([c:3]1[cH:4][cH:5][c:6](-[c:9]2[c:10]([CH2:14][CH2:15][C:16](=[O:17])[O:18][CH3:19])[cH:11][n:12][o:13]2)[cH:7][cH:8]1)([F:20])[F:21].[H-:22].[O:33]1[CH2:34][CH2:35][CH2:36][CH2:37]1>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6](-[c:9]2[c:10]([CH2:14][CH2:15][CH2:16][OH:17])[cH:11][n:12][o:13]2)[cH:7][cH:8]1)([F:20])[F:21]Participants
6
Sources & evidence
- ORD record
- ord-3a1a2536b9a446b2921af3a22bd562eb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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