Cas no 15889-88-0 (4-Oxo-4H-quinolizine-1-carboxylic acid)

4-Oxo-4H-quinolizine-1-carboxylic acid structure
15889-88-0 structure
Product Name:4-Oxo-4H-quinolizine-1-carboxylic acid
CAS No:15889-88-0
MF:C10H7NO3
MW:189.167482614517
CID:1084026
PubChem ID:15632094
Update Time:2025-04-20

4-Oxo-4H-quinolizine-1-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 4-Oxo-4H-quinolizine-1-carboxylic acid
    • 1-Carboxy-4-chinolizon od. 1-Carboxy-4H-chinolizin-4-on
    • 4H-pyrrolo[1,2-a]thieno[3,2-f][1,4]diazepine
    • 4H-Pyrrolo< 1,2-a> thieno< 3,2-f> 1,4-diazepin
    • 4H-Quinolizin-4-one-1-carboxylic acid
    • AC1L7EKG
    • SureCN9382267
    • 4-OXOQUINOLIZINE-1-CARBOXYLIC ACID
    • 15889-88-0
    • SCHEMBL474021
    • Inchi: 1S/C10H7NO3/c12-9-5-4-7(10(13)14)8-3-1-2-6-11(8)9/h1-6H,(H,13,14)
    • InChI Key: CJMRUZLKISYQCE-UHFFFAOYSA-N
    • SMILES: O=C1C=CC(C(=O)O)=C2C=CC=CN21

Computed Properties

  • Exact Mass: 189.042593085g/mol
  • Monoisotopic Mass: 189.042593085g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 1
  • Complexity: 427
  • 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: 0.6
  • Topological Polar Surface Area: 57.6?2
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