tert-Butanol → 5-(2-Fluoro-phenyl)-5-trifluoromethyl-[1,4]oxazepan-3-one
Reaction equation
[C:21]([OH:22])([CH3:23])([CH3:24])[CH3:25].[CH2:26]1[O:27][CH2:28][CH2:29][CH2:30]1.[Cl:1][CH2:2][C:3](=[O:4])[NH:5][C:6]([CH2:7][CH2:8][OH:9])([C:10]([F:11])([F:12])[F:13])[c:14]1[c:15]([F:20])[cH:16][cH:17][cH:18][cH:19]1>>[CH2:2]1[C:3](=[O:4])[NH:5][C:6]([C:10]([F:11])([F:12])[F:13])([c:14]2[c:15]([F:20])[cH:16][cH:17][cH:18][cH:19]2)[CH2:7][CH2:8][O:9]1Participants
4
Sources & evidence
- ORD record
- ord-fd1eacb0d71e436395c2b2b5626dffbc
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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