Chloride → 2-[trans-4-(3,4-Difluorophenyl)cyclohexyl]-5-butyl-1,3-dioxane
Reaction equation
[CH2:18]([CH2:19][CH2:20][CH3:21])[CH:22]([CH2:23][OH:24])[CH2:25][OH:26].[CH3:39][c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1.[Cl-:17].[F:1][c:2]1[cH:3][c:4]([CH:9]2[CH2:10][CH2:11][CH:12]([CH:15]=[O:16])[CH2:13][CH2:14]2)[cH:5][cH:6][c:7]1[F:8].[OH2:38].[c:27]1([CH3:28])[cH:29][cH:30][c:31]([S:32]([OH:33])(=[O:34])=[O:35])[cH:36][cH:37]1>>[F:1][c:2]1[cH:3][c:4]([CH:9]2[CH2:10][CH2:11][CH:12]([CH:15]3[O:16][CH2:25][CH:22]([CH2:18][CH2:19][CH2:20][CH3:21])[CH2:23][O:24]3)[CH2:13][CH2:14]2)[cH:5][cH:6][c:7]1[F:8]Participants
7
Sources & evidence
- ORD record
- ord-0a95b615cab247fe9e09218144f0a223
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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