ChemicalBook--->CAS DataBase List--->14401-73-1

14401-73-1

14401-73-1 Structure

14401-73-1 Structure
IdentificationBack Directory
[Name]

3,5-Dibromoacetophenone
[CAS]

14401-73-1
[Synonyms]

3,5-DIBROMOACETOPHENONE
3',5'-DIBROMOACETOPHENONE
Acetophenone, 3',5'-dibromo-
3,5-DIBROMOACETOPHENONE 99%MIN
Ethanone, 1-(3,5-dibromophenyl)-
1-(3,5-dibromophenyl)ethan-1-one
[Molecular Formula]

C8H6Br2O
[MDL Number]

MFCD00078665
[MOL File]

14401-73-1.mol
[Molecular Weight]

277.94
Questions And AnswerBack Directory
[Uses]

3',5'-Dibromoacetophenone is a useful research chemical.
Chemical PropertiesBack Directory
[Melting point ]

68°C
[Boiling point ]

160-164 °C(Press: 1-2 Torr)
[density ]

1.7855 (rough estimate)
[refractive index ]

1.5560 (estimate)
[storage temp. ]

Sealed in dry,Room Temperature
[Appearance]

Off-white to yellow Solid
[InChI]

InChI=1S/C8H6Br2O/c1-5(11)6-2-7(9)4-8(10)3-6/h2-4H,1H3
[InChIKey]

NHFJDRRYVMJBRJ-UHFFFAOYSA-N
[SMILES]

C(=O)(C1=CC(Br)=CC(Br)=C1)C
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319
[Precautionary statements ]

P261-P305+P351+P338
[HS Code ]

2914500090
Spectrum DetailBack Directory
[Spectrum Detail]

3,5-Dibromoacetophenone(14401-73-1)1HNMR
Hazard InformationBack Directory
[Synthesis]

N,N-Dimethylacetamide

127-19-5

3,5-Dibromoacetophenone

14401-73-1

General procedure for the synthesis of 3,5-dibromoacetophenone: To a round-bottomed flask containing 1,3,5-tribromobenzene (6.3 g, 20 mmol) and anhydrous ethyl ether (150 mL) under nitrogen protection, a n-butyllithium solution (12.5 mL, 20 mmol) was slowly added at -78 °C and stirred for 2 h at this temperature. Subsequently, a solution of N,N-dimethylacetamide (1.92 g, 22 mmol) in anhydrous ether (15 mL) was added dropwise. The reaction mixture was slowly warmed from -78°C to room temperature and stirring was continued for 20 hours. Upon completion of the reaction, extraction was carried out with ether and the solvent was removed by distillation after combining the organic phases. The product was purified by column chromatography and recrystallization to give 3,5-dibromoacetophenone in 41% yield.

[References]

[1] Patent: US2007/138945, 2007, A1. Location in patent: Page/Page column 11
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