Cas no 6715-15-7 (4,7-Methano-2H-1-benzopyran-2-one, octahydro-)

4,7-Methano-2H-1-benzopyran-2-one, octahydro- structure
6715-15-7 structure
Product Name:4,7-Methano-2H-1-benzopyran-2-one, octahydro-
CAS No:6715-15-7
MF:C10H14O2
MW:166.216963291168
CID:395258
PubChem ID:71374907
Update Time:2025-04-19

4,7-Methano-2H-1-benzopyran-2-one, octahydro- Chemical and Physical Properties

Names and Identifiers

    • 4,7-Methano-2H-1-benzopyran-2-one, octahydro-
    • (2R)-endo,endo-6-Hydroxy-bicyclo<2.2.2>octan-2-essigsaeure-lacton
    • Octahydro-2H-4,7-methano-1-benzopyran-2-one
    • 6715-15-7
    • DTXSID20797667
    • Inchi: 1S/C10H14O2/c11-10-5-7-3-6-1-2-8(7)9(4-6)12-10/h6-9H,1-5H2
    • InChI Key: ICVYXPGGWYHGIT-UHFFFAOYSA-N
    • SMILES: O1C(CC2CC3CCC2C1C3)=O

Computed Properties

  • Exact Mass: 166.09942
  • Monoisotopic Mass: 166.099379685g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 224
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 4
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2
  • Topological Polar Surface Area: 26.3?2

Experimental Properties

  • PSA: 26.3
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