Cas no 6890-38-6 (Pyrazine, 2,5-dimethyl-, 1,4-dioxide)

Pyrazine, 2,5-dimethyl-, 1,4-dioxide structure
6890-38-6 structure
Product Name:Pyrazine, 2,5-dimethyl-, 1,4-dioxide
CAS No:6890-38-6
MF:C6H8N2O2
MW:140.139921188354
CID:972470
PubChem ID:587626
Update Time:2025-04-19

Pyrazine, 2,5-dimethyl-, 1,4-dioxide Chemical and Physical Properties

Names and Identifiers

    • Pyrazine, 2,5-dimethyl-, 1,4-dioxide
    • 2,5-dimethylpyrazine 1,4-dioxide
    • 2,5-dimethyl-4-oxidopyrazin-1-ium 1-oxide
    • NSC-109851
    • NSC109851
    • 6890-38-6
    • Pyrazine,5-dimethyl-, 1,4-dioxide
    • 2,5-dimethylpyrazine-1,4-dioxide
    • DTXSID40343120
    • 3,6-Dimethyl-4-oxido-5,6-dihydro-2h-pyrazine 1-oxide
    • DS-013975
    • Inchi: 1S/C6H8N2O2/c1-5-3-8(10)6(2)4-7(5)9/h3-4H,1-2H3
    • InChI Key: QQWHPPCKIBOLLX-UHFFFAOYSA-N
    • SMILES: O=[N+]1C=C(C)N(C=C1C)[O-]

Computed Properties

  • Exact Mass: 140.05864
  • Monoisotopic Mass: 140.059
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 0
  • Complexity: 206
  • 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: -0.8
  • Topological Polar Surface Area: 46.4?2

Experimental Properties

  • PSA: 53.88
  • LogP: 1.16040
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