ChemicalBook--->CAS DataBase List--->304445-49-6

304445-49-6

304445-49-6 Structure

304445-49-6 Structure
IdentificationBack Directory
[Name]

3-FLUORO-4-BROMO-ACETOPHENONE
[CAS]

304445-49-6
[Synonyms]

3-FLUORO-4-BROMO-ACETOPHENONE
4-BROMO-3-FLUORO-ACETOPHENONE
3-Fluoro-4-bromo-caetophenone
4-Bromo-3-fluoroacetophenone,96%
1-(4-BroMo-3-fluorophenyl)ethanone
1-(4-broMo-3-fluorophenyl)ethan-1-one
Ethanone, 1-(4-broMo-3-fluorophenyl)-
6-acetyl-3-bromo-2-fluoro-1-cyclohexa-2,4-dienone
[Molecular Formula]

C8H6BrFO
[MDL Number]

MFCD00466241
[MOL File]

304445-49-6.mol
[Molecular Weight]

217.04
Chemical PropertiesBack Directory
[Boiling point ]

263.3℃
[density ]

1.535
[Fp ]

113.0℃
[storage temp. ]

Keep in dark place,Inert atmosphere,Room temperature
[form ]

Solid
[Appearance]

Off-white to yellow Solid
Safety DataBack Directory
[Symbol(GHS) ]

GHS hazard pictograms
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264b-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P362+P364-P403+P233-P501c
[HS Code ]

2914790090
Spectrum DetailBack Directory
[Spectrum Detail]

3-FLUORO-4-BROMO-ACETOPHENONE(304445-49-6)1HNMR
3-FLUORO-4-BROMO-ACETOPHENONE(304445-49-6)FT-IR
Hazard InformationBack Directory
[Synthesis]

Methylmagnesium chloride

676-58-4

4-BROMO-3-FLUORO-N-METHOXY-N-METHYL-BENZAMIDE

343564-56-7

3-FLUORO-4-BROMO-ACETOPHENONE

304445-49-6

A tetrahydrofuran solution of 3.00 M methylmagnesium chloride (125 mL, 0.38 mol) was added slowly and dropwise to a tetrahydrofuran (500 mL) solution of 4-bromo-3-fluoro-N-methoxy-N-methylbenzamide (58.5 g, 0.223 mol) at 0 °C. The reaction mixture was stirred continuously at 0 °C for 1 hour. Upon completion of the reaction, the reaction was quenched with pre-cooled saturated ammonium chloride solution (150 mL). The organic layer was separated and the remaining aqueous phase was extracted with ethyl acetate (3 x 50 mL). All organic phases were combined, washed with saturated brine, dried with anhydrous magnesium sulfate, filtered and concentrated under reduced pressure to afford the crude product 3-fluoro-4-bromoacetophenone (48.4 g, 99% yield), which could be used in the subsequent reaction without further purification.

[References]

[1] Patent: US2008/39457, 2008, A1. Location in patent: Page/Page column 41
[2] Patent: WO2008/64157, 2008, A1. Location in patent: Page/Page column 42-43
[3] Patent: US2009/291956, 2009, A1. Location in patent: Page/Page column 19
[4] Patent: US2011/212967, 2011, A1. Location in patent: Page/Page column 8
[5] Patent: WO2012/48421, 2012, A1. Location in patent: Page/Page column 24
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