Cas no 2802-07-5 ((1Z,3Z)-cyclohexane-1,3-dione dioxime)

(1Z,3Z)-cyclohexane-1,3-dione dioxime structure
2802-07-5 structure
Product Name:(1Z,3Z)-cyclohexane-1,3-dione dioxime
CAS No:2802-07-5
MF:C6H10N2O2
MW:142.155801296234
CID:914985
PubChem ID:6512196
Update Time:2025-04-19

(1Z,3Z)-cyclohexane-1,3-dione dioxime Chemical and Physical Properties

Names and Identifiers

    • (1Z,3Z)-cyclohexane-1,3-dione dioxime
    • AKOS024377831
    • 2802-07-5
    • NSC337996
    • NSC-337996
    • Inchi: 1S/C6H10N2O2/c9-7-5-2-1-3-6(4-5)8-10/h9-10H,1-4H2/b7-5-,8-6-
    • InChI Key: LXJJNDRVGGYEFQ-SFECMWDFSA-N
    • SMILES: O/N=C1\C/C(/CCC\1)=N\O

Computed Properties

  • Exact Mass: 142.0743
  • Monoisotopic Mass: 142.074227566g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 0
  • Complexity: 157
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 2
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.5
  • Topological Polar Surface Area: 65.2?2

Experimental Properties

  • PSA: 65.18
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