Cas no 1188-63-2 (4-Heptanone, oxime)

4-Heptanone, oxime structure
4-Heptanone, oxime structure
Product Name:4-Heptanone, oxime
CAS No:1188-63-2
MF:C7H15NO
MW:129.200102090836
CID:151619
PubChem ID:233598
Update Time:2025-04-19

4-Heptanone, oxime Chemical and Physical Properties

Names and Identifiers

    • 4-Heptanone, oxime
    • Dipropyl ketone oxime
    • Butyronoxim
    • di-n-propylketoxime
    • Dipropyl ketoxime
    • Dipropylketoxim
    • heptan-4-one oxime
    • Heptan-4-on-oxim
    • Heptanoxim-(4)
    • DTXSID30922786
    • VLVVDHDKRHWUSQ-UHFFFAOYSA-N
    • SCHEMBL758250
    • 4-Heptanone oxime
    • NSC32351
    • NSC-32351
    • AKOS008939679
    • N-heptan-4-ylidenehydroxylamine
    • 1188-63-2
    • Inchi: 1S/C7H15NO/c1-3-5-7(8-9)6-4-2/h9H,3-6H2,1-2H3
    • InChI Key: VLVVDHDKRHWUSQ-UHFFFAOYSA-N
    • SMILES: O/N=C(\CCC)/CCC

Computed Properties

  • Exact Mass: 129.11545
  • Monoisotopic Mass: 129.115364102g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 4
  • Complexity: 80.9
  • 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: 1.9
  • Topological Polar Surface Area: 32.6?2

Experimental Properties

  • PSA: 32.59
  • LogP: 2.41680
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