Potassium Cation → 5-(5-Bromo-2-fluorophenyl)-6,6-difluoro-5-methyl-1,4-oxazepan-3-one

HRID 2125235Notes

Reaction equation

HRID 2125235 reaction equation
[Br:7][c:8]1[cH:9][cH:10][c:11]([F:26])[c:12]([C:14]([CH3:15])([C:16]([CH2:17][OH:18])([F:19])[F:20])[NH:21][C:22]([CH2:23][Cl:24])=[O:25])[cH:13]1.[C:27]([OH:28])([CH3:29])([CH3:30])[CH3:31].[CH3:1][C:2]([CH3:3])([O-:4])[CH3:5].[K+:6]>>[Br:7][c:8]1[cH:9][cH:10][c:11]([F:26])[c:12]([C:14]2([CH3:15])[C:16]([F:19])([F:20])[CH2:17][O:18][CH2:23][C:22](=[O:25])[NH:21]2)[cH:13]1

Participants

5

Reactant 4

HCID 813Potassium CationHCID 6386tert-ButanolHCID 45749132-Methylpropan-2-olateHCID 66665738N-(2-(5-bromo-2-fluorophenyl)-3,3-difluoro-4-hydroxybutan-2-yl)-2-chloroacetamide

Product 1

HCID 666660575-(5-Bromo-2-fluorophenyl)-6,6-difluoro-5-methyl-1,4-oxazepan-3-one

Sources & evidence

ORD record
ord-8d649c0784de4e57b8548d457e857927
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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