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ChemicalBook--->CAS DataBase List--->1016228-01-5

1016228-01-5

1016228-01-5 Structure

1016228-01-5 Structure
IdentificationBack Directory
[Name]

1-(6-Bromo-3-fluoro-pyridin-2-yl)-ethanone
[CAS]

1016228-01-5
[Synonyms]

EOS-60946
1-(6-Bromo-3-fluoro-2-pyridyl)ethanone
1-(6-Bromo-3-fluoro-pyridin-2-yl)-ethanone
1-(6-bromo-3-fluoropyridin-2-yl)ethan-1-one
Ethanone, 1-(6-bromo-3-fluoro-2-pyridinyl)-
[Molecular Formula]

C7H5BrFNO
[MDL Number]

MFCD18258632
[MOL File]

1016228-01-5.mol
[Molecular Weight]

218.02
Chemical PropertiesBack Directory
[Boiling point ]

251.8±40.0 °C(Predicted)
[density ]

1.619±0.06 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,2-8°C
[pka]

-2.19±0.10(Predicted)
[Appearance]

Light brown to brown Solid
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[HS Code ]

2933399990
Spectrum DetailBack Directory
[Spectrum Detail]

1-(6-Bromo-3-fluoro-pyridin-2-yl)-ethanone(1016228-01-5)1HNMR
Hazard InformationBack Directory
[Synthesis]

1-(6-bromo-3-fluoropyridin-2-yl)ethanol

1403468-45-0

1-(6-Bromo-3-fluoro-pyridin-2-yl)-ethanone

1016228-01-5

General procedure for the synthesis of 1-(6-bromo-3-fluoropyridin-2-yl)ethanol from 1-(6-bromo-3-fluoropyridin-2-yl)ethanone: 8.74 g (39.7 mmol) of 1-(6-bromo-3-fluoropyridin-2-yl)ethanol was dissolved in 175 mL of dichloromethane at room temperature, followed by the addition of 21.4 g (99.0 mmol) of chloro chromic acid pyridinium and 7.50 g of diatomaceous earth. The reaction mixture was stirred at room temperature for 25 hours before being filtered through the diatomaceous earth and washed with dichloromethane. The dichloromethane in the filtrate was concentrated and the residue was purified by fast chromatography (using 220 g of silica gel, eluent 0 to 10% hexane solution of ethyl acetate) to afford the target product 1-(6-bromo-3-fluoropyridin-2-yl)ethanone (6.82 g, 79% yield).LCMS (condition A): retention time t R = 2.11 min, mass-to-charge ratio m/e = 218 (M + H).

[References]

[1] Patent: WO2012/139425, 2012, A1. Location in patent: Page/Page column 120
[2] Patent: WO2015/187437, 2015, A1. Location in patent: Page/Page column 57
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