Cas no 18916-45-5 (Quinoxaline, 2-methyl-, 4-oxide)

Quinoxaline,  2-methyl-,  4-oxide structure
18916-45-5 structure
Product Name:Quinoxaline, 2-methyl-, 4-oxide
CAS No:18916-45-5
MF:C9H8N2O
MW:160.17262172699
CID:123251
PubChem ID:594807
Update Time:2025-04-18

Quinoxaline, 2-methyl-, 4-oxide Chemical and Physical Properties

Names and Identifiers

    • Quinoxaline, 2-methyl-, 4-oxide
    • 2-Methylquinoxaline 4-oxide
    • 3-methyl-1-oxidoquinoxalin-1-ium
    • DTXSID10344164
    • 18916-45-5
    • Inchi: 1S/C9H8N2O/c1-7-6-11(12)9-5-3-2-4-8(9)10-7/h2-6H,1H3
    • InChI Key: GENNPRIQHQRRPM-UHFFFAOYSA-N
    • SMILES: [O-][N+]1C=C(C)N=C2C=CC=CC=12

Computed Properties

  • Exact Mass: 160.06374
  • Monoisotopic Mass: 160.063662883g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 163
  • 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: 38.4?2

Experimental Properties

  • PSA: 39.83
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