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21667-61-8

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21667-61-8 Structure

21667-61-8 Structure
IdentificationMore
[Name]

3-Fluorobenzoylacetonitrile
[CAS]

21667-61-8
[Synonyms]

3-(3'-FLUOROPHENYL)-3-OXOPROPANENITRILE
3-FLUOROBENZOYLACETONITRILE
3-Fluorobenzoylacetonitrile ,98%
[Molecular Formula]

C9H6FNO
[MDL Number]

MFCD02260777
[Molecular Weight]

163.15
[MOL File]

21667-61-8.mol
Chemical PropertiesBack Directory
[Melting point ]

69-70 °C
[Boiling point ]

304.4±22.0 °C(Predicted)
[density ]

1?+-.0.06 g/cm3(Predicted)
[storage temp. ]

Storage temp. 2-8°C
[solubility ]

Acetone (Slightly), Chloroform (Slightly), Methanol (Very Slightly)
[form ]

solid
[pka]

7.18±0.10(Predicted)
[color ]

Light Brown
[Detection Methods]

HPLC
[CAS DataBase Reference]

21667-61-8(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
[HS Code ]

2926907090
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Ethanol-->Hydrochloric acid-->Ethyl acetate-->Methanol-->Diethyl ether-->Dichloromethane-->Acetic acid-->Sodium-->Thionyl chloride-->Petroleum ether-->Toluene-->Chloroform-->Bromine-->Magnesium sulfate-->Sodium bicarbonate-->Acetonitrile-->Sodium hydride-->POTASSIUM CYANIDE-->Potassium tert-butoxide-->3-Fluorobenzoic acid-->3'-Fluoroacetophenone
Hazard InformationBack Directory
[Uses]

3-Fluorobenzoylacetonitrile can be useful in the optimization of whole-cell anticryptococcal activity and insights into the structural origins of cryptococcal resorcylate aminopyrazole HSP90 inhibitors selectivity.
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