1,1,2-Trichloroethane → 2-Methylthio-2,2,2',4'-tetrafluoroacetophenone

HRID 177294

Reaction equation

HRID 177294 reaction equation
[CH3:1][S:2][CH:3]([C:4](=[O:5])[c:6]1[c:7]([F:13])[cH:8][c:9]([F:12])[cH:10][cH:11]1)[F:14].[CH3:27][CH2:28][CH2:29][CH2:30][CH2:31][CH3:32].[Cl:33][CH2:34][CH:35]([Cl:36])[Cl:37].[F:15][n+:16]1[cH:17][cH:18][c:19]([CH3:20])[cH:21][c:22]1[S:23]([O-:24])(=[O:25])=[O:26]>>[CH3:1][S:2][C:3]([C:4](=[O:5])[c:6]1[c:7]([F:13])[cH:8][c:9]([F:12])[cH:10][cH:11]1)([F:14])[F:15]

Participants

5

Reactant 4

HCID 65741,1,2-TrichloroethaneHCID 8058HexaneHCID 2737404N-Fluoro-4-methylpyridinium-2-sulfonateHCID 106327011-(2,4-Difluorophenyl)-2-fluoro-2-(methylsulfanyl)ethanone

Product 1

HCID 102203472-Methylthio-2,2,2',4'-tetrafluoroacetophenone

Sources & evidence

ORD record
ord-8b56eff766f9473bb29b6c817abcfecc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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