Cas no 501436-07-3 (3,3'-Bipyridine, 5-bromo-2-fluoro-)

3,3'-Bipyridine, 5-bromo-2-fluoro- structure
501436-07-3 structure
Product Name:3,3'-Bipyridine, 5-bromo-2-fluoro-
CAS No:501436-07-3
MF:C10H6BrFN2
MW:253.070444583893
CID:1565964
PubChem ID:11747136
Update Time:2025-04-21

3,3'-Bipyridine, 5-bromo-2-fluoro- Chemical and Physical Properties

Names and Identifiers

    • 3,3'-Bipyridine, 5-bromo-2-fluoro-
    • 5-bromo-2-fluoro-3,3'-bipyridine
    • 501436-07-3
    • Inchi: 1S/C10H6BrFN2/c11-8-4-9(10(12)14-6-8)7-2-1-3-13-5-7/h1-6H
    • InChI Key: VCUIEVXVQSJZQF-UHFFFAOYSA-N
    • SMILES: BrC1=CN=C(C(=C1)C1C=NC=CC=1)F

Computed Properties

  • Exact Mass: 251.96988
  • Monoisotopic Mass: 251.96984g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 1
  • Complexity: 191
  • 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: 2.5
  • Topological Polar Surface Area: 25.8?2

Experimental Properties

  • PSA: 25.78
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