Cas no 411212-08-3 (8-Chloro-10-hydroxy-5-oxo-5lambda~5~-phenazin-2(10H)-one)

8-Chloro-10-hydroxy-5-oxo-5lambda~5~-phenazin-2(10H)-one structure
411212-08-3 structure
Product Name:8-Chloro-10-hydroxy-5-oxo-5lambda~5~-phenazin-2(10H)-one
CAS No:411212-08-3
MF:C12H7ClN2O3
MW:262.64858174324
CID:2634554
PubChem ID:136250580
Update Time:2025-04-21

8-Chloro-10-hydroxy-5-oxo-5lambda~5~-phenazin-2(10H)-one Chemical and Physical Properties

Names and Identifiers

    • 8-chloro-10-hydroxy-5-oxidophenazin-5-ium-2-one
    • 411212-08-3
    • 8-Chloro-10-hydroxy-5-oxo-5lambda~5~-phenazin-2(10H)-one
    • DTXSID10786843
    • Inchi: 1S/C12H7ClN2O3/c13-7-1-3-9-11(5-7)15(18)12-6-8(16)2-4-10(12)14(9)17/h1-6,16H
    • InChI Key: WMDSXLKTUGEJSE-UHFFFAOYSA-N
    • SMILES: ClC1C=CC2=C(C=1)[N+](=C1C=C(C=CC1=[N+]2[O-])O)[O-]

Computed Properties

  • Exact Mass: 262.0145198Da
  • Monoisotopic Mass: 262.0145198Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 0
  • Complexity: 320
  • 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: 0.9
  • Topological Polar Surface Area: 71.2?2
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