Cas no 161941-22-6 (Bicyclo[3.2.0]heptan-2-one, 7,7-difluoro- (9CI))

Bicyclo[3.2.0]heptan-2-one, 7,7-difluoro- (9CI) structure
161941-22-6 structure
Product Name:Bicyclo[3.2.0]heptan-2-one, 7,7-difluoro- (9CI)
CAS No:161941-22-6
MF:C7H8F2O
MW:146.134629249573
CID:904623
PubChem ID:14939334
Update Time:2025-04-19

Bicyclo[3.2.0]heptan-2-one, 7,7-difluoro- (9CI) Chemical and Physical Properties

Names and Identifiers

    • Bicyclo[3.2.0]heptan-2-one, 7,7-difluoro- (9CI)
    • 161941-22-6
    • Bicyclo[3.2.0]heptan-2-one, 7,7-difluoro-
    • 7,7-Difluorobicyclo[3.2.0]heptan-2-one
    • Inchi: 1S/C7H8F2O/c8-7(9)3-4-1-2-5(10)6(4)7/h4,6H,1-3H2
    • InChI Key: FJTZIGNYUXTTJL-UHFFFAOYSA-N
    • SMILES: FC1(CC2CCC(C21)=O)F

Computed Properties

  • Exact Mass: 146.05434
  • Monoisotopic Mass: 146.05432120g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 0
  • Complexity: 188
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.1
  • Topological Polar Surface Area: 17.1?2

Experimental Properties

  • PSA: 17.07
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