Cas no 120464-88-2 (6-Acetyl-1-phenazinecarboxylic acid)

6-Acetyl-1-phenazinecarboxylic acid structure
120464-88-2 structure
Product Name:6-Acetyl-1-phenazinecarboxylic acid
CAS No:120464-88-2
MF:C15H10N2O3
MW:266.25150346756
CID:1998949
PubChem ID:443635
Update Time:2025-04-21

6-Acetyl-1-phenazinecarboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 6-Acetyl-1-phenazinecarboxylic acid
    • 6-acetylphenazine-1-carboxylic acid
    • 6-Acetyl-1-phenazinecarboxylic acid #
    • 120464-88-2
    • ACMC-20moxt
    • Q27110101
    • VRKHKGIAJQUVOY-UHFFFAOYSA-N
    • 1-Phenazinecarboxylic acid, 6-acetyl-
    • 6-Acetophenazine-1-carboxylic acid
    • CHEBI:29501
    • SCHEMBL19971558
    • C12120
    • DTXSID10332122
    • AC1L9EXZ
    • Inchi: 1S/C15H10N2O3/c1-8(18)9-4-2-6-11-13(9)16-12-7-3-5-10(15(19)20)14(12)17-11/h2-7H,1H3,(H,19,20)
    • InChI Key: VRKHKGIAJQUVOY-UHFFFAOYSA-N
    • SMILES: O=C(C)C1=CC=CC2C1=NC1C=CC=C(C(=O)O)C=1N=2

Computed Properties

  • Exact Mass: 266.06914219g/mol
  • Monoisotopic Mass: 266.06914219g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 2
  • Complexity: 412
  • 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: 1.8
  • Topological Polar Surface Area: 80.2?2
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