Cas no 78686-85-8 (3-Pyridinecarbonylchloride, 6-chloro-5-fluoro-)

3-Pyridinecarbonylchloride, 6-chloro-5-fluoro- structure
78686-85-8 structure
Product Name:3-Pyridinecarbonylchloride, 6-chloro-5-fluoro-
CAS No:78686-85-8
MF:C6H2Cl2FNO
MW:193.990582942963
CID:553423
PubChem ID:12677296
Update Time:2025-04-19

3-Pyridinecarbonylchloride, 6-chloro-5-fluoro- Chemical and Physical Properties

Names and Identifiers

    • 3-Pyridinecarbonylchloride, 6-chloro-5-fluoro-
    • 3-Pyridinecarbonylchloride,6-chloro-5-fluoro-(9CI)
    • 6-chloro-5-fluoropyridine-3-carbonyl chloride
    • 78686-85-8
    • 6-Chloro-5-fluoronicotinoyl chloride
    • DTXSID50506562
    • 6-Chloro-5-fluoronicotinoylchloride
    • Inchi: 1S/C6H2Cl2FNO/c7-5-4(9)1-3(2-10-5)6(8)11/h1-2H
    • InChI Key: FKRLFHNLVXWQFF-UHFFFAOYSA-N
    • SMILES: ClC1=C(C=C(C(=O)Cl)C=N1)F

Computed Properties

  • Exact Mass: 192.9497472g/mol
  • Monoisotopic Mass: 192.9497472g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 167
  • 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: 2.4
  • Topological Polar Surface Area: 30?2
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