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CS-W001157 4
Total: USD 88.00

8-Bromo-5-fluoroquinoline

  • CAS No. 917251-99-1

  • Cat. No. CS-0041930
  • Purity≥96%
  • MDL No.MFCD09907839

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

8-Bromo-5-fluoroquinoline|CS-0041930

Structure of 917251-99-1

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General Information

  • CAS No. 917251-99-1
  • Cat. No. CS-0041930
  • Purity ≥96%
  • MDL No. MFCD09907839
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₅BrFN
  • Molecular Weight 226.05
  • Synonym(s) None
  • SMILES FC1=C2C=CC=NC2=C(Br)C=C1

Description

8-Bromo-5-fluoroquinoline is a halogenated quinoline derivative featuring complementary electrophilic and nucleophilic sites. This electron-deficient heterocycle enables efficient coupling reactions in cross-coupling protocols. The strategic placement of bromo and fluoro groups facilitates selective functionalization, enhancing utility in medicinal chemistry and materials science applications.

Application

8-Bromo-5-fluoroquinoline serves as a versatile building block in medicinal chemistry, enabling palladium-catalyzed cross-coupling reactions due to its complementary halogenation pattern. The bromo and fluoro substituents offer orthogonal reactivity for sequential functionalization, while the quinoline core provides inherent stability and π-system character suitable for drug-like scaffolds. Its bench-stable, crystalline form facilitates handling and purification in synthetic workflows.

Synthesis

  • Route1

    References

    • Wyeth Patent: US2007/27160 A1, 2007 ; Location in patent: Page/Page column 66 ; US 20070027160 A1
  • Route2
    • null|null
      100-02-7
    • In-stock
      2-Bromo-5-fluoroaniline|CS-W001130
      1003-99-2
    • ~85%
    • In-stock
      8-Bromo-5-fluoroquinoline|CS-0041930
      917251-99-1

    References

    • WYETH Patent: WO2007/146202 A2, 2007 ; Location in patent: Page/Page column 31 ;
  • Route3

    References

    • Wyeth Patent: US2007/299083 A1, 2007 ; Location in patent: Page/Page column 9 ; US 20070299083 A1

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   12.89
  • LogP   3.1364
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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