Cas no 1207448-30-3 (1-bromo-5-fluoroisoquinoline)

1-Bromo-5-fluoroisoquinoline is a halogenated isoquinoline derivative with significant utility in pharmaceutical and agrochemical research. Its bromo and fluoro substituents enhance reactivity, making it a versatile intermediate for cross-coupling reactions, such as Suzuki or Buchwald-Hartwig amination. The electron-withdrawing fluorine atom improves metabolic stability in drug development, while the bromine serves as a handle for further functionalization. This compound is particularly valuable in the synthesis of bioactive molecules, including kinase inhibitors and other heterocyclic scaffolds. High purity grades ensure consistent performance in demanding applications. Its stability under standard storage conditions further supports its use in multistep synthetic routes.
1-bromo-5-fluoroisoquinoline structure
1-bromo-5-fluoroisoquinoline structure
Product Name:1-bromo-5-fluoroisoquinoline
CAS No:1207448-30-3
MF:C9H5BrFN
MW:226.04510474205
CID:2617251
PubChem ID:71743745
Update Time:2025-05-27

1-bromo-5-fluoroisoquinoline Chemical and Physical Properties

Names and Identifiers

    • 1-bromo-5-fluoroisoquinoline
    • AKOS022879522
    • CS-0270574
    • F2147-8765
    • EN300-398216
    • 1207448-30-3
    • DTXSID30857367
    • MDL: MFCD15832818
    • Inchi: 1S/C9H5BrFN/c10-9-7-2-1-3-8(11)6(7)4-5-12-9/h1-5H
    • InChI Key: MMUXEDGAYKKLLM-UHFFFAOYSA-N
    • SMILES: BrC1C2C=CC=C(C=2C=CN=1)F

Computed Properties

  • Exact Mass: 224.95894Da
  • Monoisotopic Mass: 224.95894Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 165
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.2
  • Topological Polar Surface Area: 12.9?2

1-bromo-5-fluoroisoquinoline Pricemore >>

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