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CS-W001157 4
Total: USD 88.00

1-Bromo-2-(trifluoromethyl)benzene

  • CAS No. 392-83-6

  • Cat. No. CS-0016026
  • Purity≥98%
  • MDL No.MFCD00000373

*For research and further manufacturing use only, not for direct human use.

1-Bromo-2-(trifluoromethyl)benzene|CS-0016026

Structure of 392-83-6

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General Information

  • CAS No. 392-83-6
  • Cat. No. CS-0016026
  • Purity ≥98%
  • MDL No. MFCD00000373
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₄BrF₃
  • Molecular Weight 225.01
  • Synonym(s) o-bromotrifluorotoluene
  • SMILES FC(C1=CC=CC=C1Br)(F)F

Description

1-Bromo-2-(trifluoromethyl)benzene features a strategically positioned trifluoromethyl group that enhances electron-withdrawal and metabolic stability. This aryl halide integrates readily into cross-coupling reactions, delivering fluorinated aromatic scaffolds with high functional group tolerance under standard conditions.

Application

1-Bromo-2-(trifluoromethyl)benzene serves as a versatile aryl halide building block in cross-coupling reactions, enabling efficient construction of biaryl scaffolds under standard Pd-catalyzed conditions. The ortho-trifluoromethyl group enhances metabolic stability and modulates electronic properties, making it valuable for medicinal chemistry applications. Its bench-stable nature and compatibility with diverse functional groups facilitate straightforward purification and integration into complex synthetic sequences.

Synthesis

  • Route1
    • In-stock
      1-Bromo-2-iodobenzene|CS-W008713
      583-55-1
    • null|null
      77152-08-0
    • ~93%
    • In-stock
      1-Bromo-2-(trifluoromethyl)benzene|CS-0016026
      392-83-6

    References

    • Serizawa, Hiroki; Aikawa, Kohsuke; Mikami, Koichi Chemistry - A European Journal, 2013 , vol. 19, # 52 p. 17692 - 17697
  • Route2

    References

    • Central Glass Company, Limited Patent: US4968852 A1, 1990 ;
  • Route3
    • null|null
      98-08-8
    • ~%
    • In-stock
      1-Bromo-2-(trifluoromethyl)benzene|CS-0016026
      392-83-6

    References

    • Benkeser; Severson Journal of the American Chemical Society, 1951 , vol. 73, p. 1353

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS02
Signal Word : Warning
UN#: 1993
Class : 3
Packing Group : Ⅲ
Hazard Statements : H226
Precautionary Statements : P210-P233-P240-P241-P242-P243-P280-P370+P378-P501

Quality Control

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Computational Chemistry Data

  • TPSA   0
  • LogP   3.4679
  • H_Acceptors   0
  • H_Donors   0
  • Rotatable_Bonds   0

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