Cas no 90415-32-0 (3-Cinnolinecarboxylic acid, 5,6-dichloro-4-hydroxy-)

3-Cinnolinecarboxylic acid, 5,6-dichloro-4-hydroxy- structure
90415-32-0 structure
Product Name:3-Cinnolinecarboxylic acid, 5,6-dichloro-4-hydroxy-
CAS No:90415-32-0
MF:C9H4Cl2N2O3
MW:259.045660018921
CID:1954290
PubChem ID:84819589
Update Time:2025-04-21

3-Cinnolinecarboxylic acid, 5,6-dichloro-4-hydroxy- Chemical and Physical Properties

Names and Identifiers

    • 3-Cinnolinecarboxylic acid, 5,6-dichloro-4-hydroxy-
    • 90415-32-0
    • 5,6-Dichloro-4-oxo-1,4-dihydrocinnoline-3-carboxylic acid
    • 5,6-DICHLORO-4-OXO-1H-CINNOLINE-3-CARBOXYLIC ACID
    • 5,6-Dichloro-4-oxo-1,4-dihydrocinnoline-3-carboxylicacid
    • 5,6-Dichloro-4-hydroxy-3-cinnolinecarboxylic acid
    • DTXSID301232865
    • Inchi： 1S/C9H4Cl2N2O3/c10-3-1-2-4-5(6(3)11)8(14)7(9(15)16)13-12-4/h1-2H,(H,12,14)(H,15,16)
    • InChI Key： FZEUJWZOBXKYSD-UHFFFAOYSA-N
    • SMILES： ClC1=C(C=CC2=C1C(C(C(=O)O)=NN2)=O)Cl

Computed Properties

  • Exact Mass: 257.96
  • Monoisotopic Mass: 257.96
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 1
  • Complexity: 372
  • 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: 78.8A^2
  • XLogP3: 3

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