Cas no 90418-64-7 (1,5-Naphthyridine-3-carboxylic acid)

1,5-Naphthyridine-3-carboxylic acid structure
90418-64-7 structure
Product Name:1,5-Naphthyridine-3-carboxylic acid
CAS No:90418-64-7
MF:C9H6N2O2
MW:174.156141757965
MDL:MFCD13179643
CID:1037791
PubChem ID:18663323
Update Time:2024-10-26

1,5-Naphthyridine-3-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 1,5-Naphthyridine-3-carboxylic acid
    • 1,5-phthyridine-3-carboxylic acid
    • AB66652
    • V8914
    • 1,5-Naphthyridine-3-carboxylic acid, AldrichCPR
    • 5-Azaquinoline-3-carboxylic acid
    • F1957-0070
    • 1,5-Naphthyridine-3-carboxylicacid
    • AKOS005208395
    • CS-0155782
    • EN300-132663
    • AS-62093
    • 90418-64-7
    • DB-078676
    • SCHEMBL626577
    • A11739
    • MFCD13179643
    • DTXSID80595388
    • MDL: MFCD13179643
    • Inchi: 1S/C9H6N2O2/c12-9(13)6-4-8-7(11-5-6)2-1-3-10-8/h1-5H,(H,12,13)
    • InChI Key: BWIFRKKQXKCKQQ-UHFFFAOYSA-N
    • SMILES: O=C(C1C=C2C(C=CC=N2)=NC=1)O

Computed Properties

  • Exact Mass: 174.042927438g/mol
  • Monoisotopic Mass: 174.042927438g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 208
  • 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
  • Topological Polar Surface Area: 63.1
  • XLogP3: 0.7

Experimental Properties

  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 366.8±27.0 °C at 760 mmHg
  • Flash Point: 175.6±23.7 °C
  • Vapor Pressure: 0.0±0.9 mmHg at 25°C

1,5-Naphthyridine-3-carboxylic acid Security Information

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