Ethanol → 2,6-Difluoro-4-(trans-4-pentylcyclohexyl)-benzoic acid
Reaction equation
[CH3:25][CH2:26][OH:27].[F:1][c:2]1[c:3]([C:4]#[N:5])[c:6]([F:21])[cH:7][c:8]([CH:10]2[CH2:11][CH2:12][CH:13]([CH2:16][CH2:17][CH2:18][CH2:19][CH3:20])[CH2:14][CH2:15]2)[cH:9]1.[K+:23].[OH-:22].[OH2:24]>>[F:1][c:2]1[c:3]([C:4](=[O:22])[OH:24])[c:6]([F:21])[cH:7][c:8]([CH:10]2[CH2:11][CH2:12][CH:13]([CH2:16][CH2:17][CH2:18][CH2:19][CH3:20])[CH2:14][CH2:15]2)[cH:9]1Participants
6
Sources & evidence
- ORD record
- ord-b403ac83e41848cfa8650be72b5a786c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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