Trichloroacetic Acid → 2,2,3,3,4,4,5,5,6,6-Decafluoro-1-(trichloromethyl)-1-cyclohexanol

Reaction equation

[CH3:25][N:26]([P:27]([N:28]([CH3:29])[CH3:30])([N:31]([CH3:32])[CH3:33])=[O:34])[CH3:35].[F:1][C:2]1([F:17])[C:3](=[O:16])[C:4]([F:14])([F:15])[C:5]([F:12])([F:13])[C:6]([F:10])([F:11])[C:7]1([F:8])[F:9].[OH:18][C:19](=[O:20])[C:21]([Cl:22])([Cl:23])[Cl:24]>>[F:1][C:2]1([F:17])[C:3]([OH:16])([C:21]([Cl:22])([Cl:23])[Cl:24])[C:4]([F:14])([F:15])[C:5]([F:12])([F:13])[C:6]([F:10])([F:11])[C:7]1([F:8])[F:9]

Participants

Reactant 3

HCID 6421Trichloroacetic Acid

HCID 12679Hexamethylphosphoramide

HCID 12570757Decafluorocyclohexanone

Product 1

HCID 226252362,2,3,3,4,4,5,5,6,6-Decafluoro-1-(trichloromethyl)-1-cyclohexanol

Sources & evidence

ORD record: ord-7f41a2ed88ae47609e9c0c79ae6feb1a
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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