Chloride → 1-(3-Fluoro-4-methoxyphenyl)hexan-1-one

HRID 102221

Reaction equation

HRID 102221 reaction equation
[Al+3:2].[C:14]([CH2:15][CH2:16][CH2:17][CH2:18][CH3:19])(=[O:20])[Cl:21].[Cl-:1].[Cl-:3].[Cl-:4].[ClH:22].[F:5][c:6]1[c:7]([O:12][CH3:13])[cH:8][cH:9][cH:10][cH:11]1>>[F:5][c:6]1[c:7]([O:12][CH3:13])[cH:8][cH:9][c:10]([C:14]([CH2:15][CH2:16][CH2:17][CH2:18][CH3:19])=[O:20])[cH:11]1

Participants

6

Reactant 5

HCID 312Chloride3×HCID 313Hydrochloric AcidHCID 67340Hexanoyl chlorideHCID 675762-FluoroanisoleHCID 104727Aluminum Cation

Product 1

HCID 219909101-(3-Fluoro-4-methoxyphenyl)hexan-1-one

Sources & evidence

ORD record
ord-d9d42bcb6f68416b8cf2e4df327bcb41
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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