Cas no 7467-13-2 ((1Z)-3-ethoxycyclohex-2-en-1-one oxime)

(1Z)-3-ethoxycyclohex-2-en-1-one oxime structure
7467-13-2 structure
Product Name:(1Z)-3-ethoxycyclohex-2-en-1-one oxime
CAS No:7467-13-2
MF:C8H13NO2
MW:155.194322347641
CID:979765
PubChem ID:5793204
Update Time:2025-04-19

(1Z)-3-ethoxycyclohex-2-en-1-one oxime Chemical and Physical Properties

Names and Identifiers

    • (1Z)-3-ethoxycyclohex-2-en-1-one oxime
    • (NZ)-N-(3-ethoxycyclohex-2-en-1-ylidene)hydroxylamine
    • 7467-13-2
    • 2-Cyclohexen-1-one, 3-ethoxy-, oxime
    • SCHEMBL16879790
    • NSC400649
    • DTXSID60420982
    • Inchi: 1S/C8H13NO2/c1-2-11-8-5-3-4-7(6-8)9-10/h6,10H,2-5H2,1H3/b9-7+
    • InChI Key: VAQPUYAXHMVDTB-VQHVLOKHSA-N
    • SMILES: O(CC)C1=C/C(/CCC1)=N/O

Computed Properties

  • Exact Mass: 155.09469
  • Monoisotopic Mass: 155.094628657g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 185
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.2
  • Topological Polar Surface Area: 41.8?2

Experimental Properties

  • Density: 1.1
  • Boiling Point: 298.7°C at 760 mmHg
  • Flash Point: 134.5°C
  • Refractive Index: 1.51
  • PSA: 41.82
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