Cas no 31483-97-3 (Bicyclo[3.2.1]octan-2-one, oxime)

Bicyclo[3.2.1]octan-2-one, oxime structure
31483-97-3 structure
Product Name:Bicyclo[3.2.1]octan-2-one, oxime
CAS No:31483-97-3
MF:C8H13NO
MW:139.194922208786
CID:323748
PubChem ID:5987274
Update Time:2025-04-19

Bicyclo[3.2.1]octan-2-one, oxime Chemical and Physical Properties

Names and Identifiers

    • Bicyclo[3.2.1]octan-2-one, oxime
    • N-(4-bicyclo[3.2.1]octanylidene)hydroxylamine
    • bicyclo [3.2.1]octan
    • Bicyclo < 3.2.1> octan
    • bicyclo(3,2,1)-octane
    • bicyclo[3.2.1.]octane
    • Bicyclo[3.2.1]octane
    • bicyclo< 3.2.1> octan-2-one oxime
    • Bicyclo< 3.2.1> octane
    • Bicyclo< 3.2.1> octanon-(2)-oxim
    • NSC98594
    • NSC-98594
    • 31483-97-3
    • Inchi: 1S/C8H13NO/c10-9-8-4-2-6-1-3-7(8)5-6/h6-7,10H,1-5H2/b9-8+
    • InChI Key: BCTNLASZDQVROJ-CMDGGOBGSA-N
    • SMILES: O/N=C1\CCC2CCC\1C2

Computed Properties

  • Exact Mass: 139.09979
  • Monoisotopic Mass: 139.099714038g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 0
  • Complexity: 165
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.6
  • Topological Polar Surface Area: 32.6?2

Experimental Properties

  • PSA: 32.59
  • LogP: 2.02670
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