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CS-W001157 4
Total: USD 88.00

4-Bromo-4'-fluorobiphenyl

  • CAS No. 398-21-0

  • Cat. No. CS-0009418
  • Purity≥96%
  • MDL No.MFCD00017954

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

4-Bromo-4'-fluorobiphenyl|CS-0009418

Structure of 398-21-0

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General Information

  • CAS No. 398-21-0
  • Cat. No. CS-0009418
  • Purity ≥96%
  • MDL No. MFCD00017954
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₈BrF
  • Molecular Weight 251.09
  • Synonym(s) 4-Bromo-4'-fluoro-1,1'-biphenyl
  • SMILES FC(C=C1)=CC=C1C2=CC=C(Br)C=C2

Application

4-Bromo-4'-fluorobiphenyl serves as a versatile building block in cross-coupling chemistry, enabling efficient construction of biaryl scaffolds under palladium-catalyzed conditions. Its orthogonal halogen reactivity allows selective functionalization at either the bromo or fluoro position, facilitating sequential coupling strategies. The compound exhibits excellent bench stability and is readily purified by column chromatography, making it well-suited for iterative synthesis in medicinal chemistry and materials science applications.

Synthesis

  • Route1

    References

    • Steiniger, Bjoern; Wuest, Frank R. Journal of Labelled Compounds and Radiopharmaceuticals, 2006 , vol. 49, # 9 p. 817 - 827
  • Route2

    References

    • Nagaki, Aiichiro; Uesugi, Yuki; Kim, Heejin; Yoshida, Jun-Ichi Chemistry - An Asian Journal, 2013 , vol. 8, # 4 p. 705 - 708
  • Route3
    • null|null
      462-06-6
    • In-stock
      1-Bromo-4-(trimethylsilyl)benzene|CS-D0587
      6999-03-7
    • ~5%
    • In-stock
      4-Bromo-4'-fluorobiphenyl|CS-0009418
      398-21-0

    References

    • Ball, Liam T.; Lloyd-Jones, Guy C.; Russell, Christopher A. Science (Washington, DC, United States), 2012 , vol. 337, # 6102 p. 1644 - 1648,5

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07,GHS09
Signal Word : Danger
UN#: 3152
Class : 9
Packing Group : Ⅱ
Hazard Statements : H302-H318-H410
Precautionary Statements : P264-P270-P273-P280-P280

Quality Control

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Computational Chemistry Data

  • TPSA   0
  • LogP   4.2552
  • H_Acceptors   0
  • H_Donors   0
  • Rotatable_Bonds   1

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