Pyridine → 4-(trans-4-Octylcyclohexanecarbonyloxy)-2,3-difluorobenzonitrile
Reaction equation
[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH3:8])[CH:9]1[CH2:10][CH2:11][CH:12]([C:15](=[O:16])[Cl:17])[CH2:13][CH2:14]1.[CH2:48]([Cl:49])[Cl:50].[CH3:41][c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1.[Cl:18][C:19]([C:20]([Cl:21])=[O:22])=[O:23].[F:24][c:25]1[c:26]([OH:34])[cH:27][cH:28][c:29]([C:32]#[N:33])[c:30]1[F:31].[cH:35]1[cH:36][cH:37][n:38][cH:39][cH:40]1>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH3:8])[CH:9]1[CH2:10][CH2:11][CH:12]([C:15](=[O:16])[O:34][c:26]2[c:25]([F:24])[c:30]([F:31])[c:29]([C:32]#[N:33])[cH:28][cH:27]2)[CH2:13][CH2:14]1Participants
7
Sources & evidence
- ORD record
- ord-bad9b20d7ed94025963c04d39b878f84
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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