Cas no 860565-30-6 (Benzo[h]quinoline-4-carbonitrile)

Benzo[h]quinoline-4-carbonitrile structure
860565-30-6 structure
Product Name:Benzo[h]quinoline-4-carbonitrile
CAS No:860565-30-6
MF:C14H8N2
MW:204.226722717285
CID:718191
PubChem ID:57358924
Update Time:2025-04-19

Benzo[h]quinoline-4-carbonitrile Chemical and Physical Properties

Names and Identifiers

    • Benzo[h]quinoline-4-carbonitrile
    • 7,8-Benzoquinoline-4-nitrile (3CI)
    • DTXSID00724294
    • 860565-30-6
    • Inchi: 1S/C14H8N2/c15-9-11-7-8-16-14-12-4-2-1-3-10(12)5-6-13(11)14/h1-8H
    • InChI Key: FAMRHESCAIINAK-UHFFFAOYSA-N
    • SMILES: N1C=CC(C#N)=C2C=CC3C=CC=CC=3C=12

Computed Properties

  • Exact Mass: 204.068748264g/mol
  • Monoisotopic Mass: 204.068748264g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 0
  • Complexity: 303
  • 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: 36.7?2
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