Cas no 841297-69-6 (2-Phenylquinoline-7-carboxylic acid)

2-Phenylquinoline-7-carboxylic acid structure
841297-69-6 structure
Product Name:2-Phenylquinoline-7-carboxylic acid
CAS No:841297-69-6
MF:C16H11NO2
MW:249.264044046402
CID:828093
PubChem ID:15946871
Update Time:2024-10-26

2-Phenylquinoline-7-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 2-Phenylquinoline-7-carboxylic acid
    • 2-phenyl-7-Quinolinecarboxylic acid
    • 2-Phenyl-7-quinolinecarboxylic acid (ACI)
    • SB69735
    • KCKFTFSVGYDHAW-UHFFFAOYSA-N
    • DTXSID20580197
    • BCP26901
    • AKOS015900028
    • CS-M1230
    • CS-13830
    • 2-phenylquinoline-7-carboxylicacid
    • 2-Phenyl-quinoline-7-carboxylic Acid
    • SCHEMBL4124819
    • DB-000865
    • 7-Quinolinecarboxylic acid, 2-phenyl-
    • 841297-69-6
    • MDL: MFCD12924847
    • Inchi: 1S/C16H11NO2/c18-16(19)13-7-6-12-8-9-14(17-15(12)10-13)11-4-2-1-3-5-11/h1-10H,(H,18,19)
    • InChI Key: KCKFTFSVGYDHAW-UHFFFAOYSA-N
    • SMILES: O=C(C1C=C2C(C=CC(C3C=CC=CC=3)=N2)=CC=1)O

Computed Properties

  • Exact Mass: 249.078978594g/mol
  • Monoisotopic Mass: 249.078978594g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 2
  • Complexity: 325
  • 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: 3.4
  • Topological Polar Surface Area: 50.2?2

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