Cas no 7207-50-3 (octanone-3-oxime)

octanone-3-oxime structure
octanone-3-oxime structure
Product Name:octanone-3-oxime
CAS No:7207-50-3
MF:C8H17NO
MW:143.226682424545
CID:862624
PubChem ID:9576965
Update Time:2025-04-19

octanone-3-oxime Chemical and Physical Properties

Names and Identifiers

    • octanone-3-oxime
    • LogP
    • (NE)-N-octan-3-ylidenehydroxylamine
    • SCHEMBL167678
    • 7207-50-3
    • Inchi: 1S/C8H17NO/c1-3-5-6-7-8(4-2)9-10/h10H,3-7H2,1-2H3/b9-8+
    • InChI Key: ODXYAIIKLLODAU-CMDGGOBGSA-N
    • SMILES: O/N=C(\CC)/CCCCC

Computed Properties

  • Exact Mass: 143.13111
  • Monoisotopic Mass: 143.131014166g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 5
  • Complexity: 99.4
  • 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: 2.6
  • Topological Polar Surface Area: 32.6?2

Experimental Properties

  • PSA: 32.59
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