1-(3-Bromo-2-fluorophenyl)-2,2,2-trifluoroethanone | CAS No. 871353-32-1

1-(3-Bromo-2-fluorophenyl)-2,2,2-trifluoroethanone

Basic Information

CAS Number

871353-32-1

Molecular Formula

C8H3BrF4O

Molecular Weight

271.01 g/mol

AD

Basic Physical Properties

Fc1c(Br)cccc1C(=O)C(F)(F)F

InChI

InChI=1S/C8H3BrF4O/c9-5-3-1-2-4(6(5)10)7(14)8(11,12)13/h1-3H

InChIKey

WZYRDTLSYWHILE-UHFFFAOYSA-N

LogP

3.3331999999999997

Topological Polar Surface Area

17.07 Ų

Hydrogen Bond Donor/Acceptor

0 / 1

Synonyms & References

English

  • 1-(3-Bromo-2-fluorophenyl)-2,2,2-trifluoroethanone
  • 1-(3-Bromo-2-fluorophenyl)-2,2,2-trifluoroethan-1-one
  • 3'-Bromo-2,2,2,2'-Tetrafluoroacetophenone 97%
  • 1-(3-Bromo-2-fluoro-phenyl)-2,2,2-trifluoro-ethanone

MDL Number

MFCD25541891

FAQ

What are the physical and chemical properties of 1-(3-Bromo-2-fluorophenyl)-2,2,2-trifluoroethanone (CAS: 871353-32-1)?

1-(3-Bromo-2-fluorophenyl)-2,2,2-trifluoroethanone is a crystalline compound with a molecular weight of approximately 340.03 g/mol. It has a low solubility in water but is more soluble in organic solvents like dichloromethane and acetone. The compound is known for its reactivity, particularly in electrophilic aromatic substitution and nucleophilic addition reactions.

How is 1-(3-Bromo-2-fluorophenyl)-2,2,2-trifluoroethanone (CAS: 871353-32-1) typically synthesized?

1-(3-Bromo-2-fluorophenyl)-2,2,2-trifluoroethanone is typically synthesized via a multistep process involving bromination and subsequent alkylation reactions. Commonly, the 2-fluorophenyl ring is brominated first, and then trifluoroethanone is introduced through nucleophilic addition. The use of a palladium catalyst can improve the selectivity and yield of the product.

What industries use 1-(3-Bromo-2-fluorophenyl)-2,2,2-trifluoroethanone (CAS: 871353-32-1)?

1-(3-Bromo-2-fluorophenyl)-2,2,2-trifluoroethanone is utilized in pharmaceuticals for the synthesis of various drug precursors and in the semiconductor industry for the production of organic semiconductors. It is also explored in polymer applications for its unique chemical and physical properties.

What precautions should be taken when handling 1-(3-Bromo-2-fluorophenyl)-2,2,2-trifluoroethanone (CAS: 871353-32-1)?

When handling 1-(3-Bromo-2-fluorophenyl)-2,2,2-trifluoroethanone, it is crucial to wear appropriate personal protective equipment (PPE) including gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood to prevent inhalation of vapors. Spills should be cleaned up with caution, using appropriate absorbent materials, and disposing of waste according to local regulations. Always refer to the Safety Data Sheet (SDS) for detailed handling instructions.

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