Ethanol → 4-[3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]benzoic acid
Reaction equation
[CH3:27][CH2:28][OH:29].[F:1][C:2]([c:3]1[n:4][n:5](-[c:12]2[cH:13][cH:14][c:15]([C:16](=[O:17])[O:18][CH3:19])[cH:20][cH:21]2)[c:6]2[c:11]1[CH2:10][CH2:9][CH2:8][CH2:7]2)([F:22])[F:23].[Na+:25].[OH-:24].[OH2:26]>>[F:1][C:2]([c:3]1[n:4][n:5](-[c:12]2[cH:13][cH:14][c:15]([C:16](=[O:17])[OH:18])[cH:20][cH:21]2)[c:6]2[c:11]1[CH2:10][CH2:9][CH2:8][CH2:7]2)([F:22])[F:23]Participants
6
Sources & evidence
- ORD record
- ord-0d081031a8f04edb9d87462f76530e3e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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