Cas no 115798-89-5 (Quinoxaline,5,6-dimethyl-, 1-oxide)

Quinoxaline,5,6-dimethyl-, 1-oxide structure
115798-89-5 structure
Product Name:Quinoxaline,5,6-dimethyl-, 1-oxide
CAS No:115798-89-5
MF:C10H10N2O
MW:174.199202060699
CID:130936
PubChem ID:45121550
Update Time:2025-04-19

Quinoxaline,5,6-dimethyl-, 1-oxide Chemical and Physical Properties

Names and Identifiers

    • Quinoxaline,5,6-dimethyl-, 1-oxide
    • 5,6-Dimethylquinoxaline 1-oxide
    • 115798-89-5
    • Quinoxaline, 5,6-dimethyl-, 1-oxide
    • Inchi: 1S/C10H10N2O/c1-7-3-4-9-10(8(7)2)11-5-6-12(9)13/h3-6H,1-2H3
    • InChI Key: XENNOLPEVZKQMH-UHFFFAOYSA-N
    • SMILES: [O-][N+]1C=CN=C2C=1C=CC(C)=C2C

Computed Properties

  • Exact Mass: 174.0794
  • Monoisotopic Mass: 174.079312947g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 0
  • Complexity: 186
  • 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: 1.6
  • Topological Polar Surface Area: 38.4?2

Experimental Properties

  • PSA: 39.83
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