Cas no 7207-51-4 (octanone-4-oxime)

octanone-4-oxime structure
octanone-4-oxime structure
Product Name:octanone-4-oxime
CAS No:7207-51-4
MF:C8H17NO
MW:143.226682424545
CID:862623
PubChem ID:9576966
Update Time:2025-04-19

octanone-4-oxime Chemical and Physical Properties

Names and Identifiers

    • octanone-4-oxime
    • LogP
    • 7207-51-4
    • Inchi： 1S/C8H17NO/c1-3-5-7-8(9-10)6-4-2/h10H,3-7H2,1-2H3/b9-8+
    • InChI Key： AKLMPECUKBNPII-CMDGGOBGSA-N
    • SMILES： O/N=C(\CCC)/CCCC

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: 2.4
  • Topological Polar Surface Area: 32.6?2

Experimental Properties

  • Density: 0.887
  • Boiling Point: 227.477°C at 760 mmHg
  • Flash Point: 124.64°C
  • Refractive Index: 1.445
  • PSA: 32.59

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