Cas no 32162-27-9 (3-Oxatricyclo[4.1.1.02,4]octane,2,7,7-trimethyl-, (1R,2R,4S,6R)-rel-)

3-Oxatricyclo[4.1.1.02,4]octane,2,7,7-trimethyl-, (1R,2R,4S,6R)-rel- structure
32162-27-9 structure
Product Name:3-Oxatricyclo[4.1.1.02,4]octane,2,7,7-trimethyl-, (1R,2R,4S,6R)-rel-
CAS No:32162-27-9
MF:C10H16O
MW:152.233443260193
CID:308594
PubChem ID:84531
Update Time:2025-04-19

3-Oxatricyclo[4.1.1.02,4]octane,2,7,7-trimethyl-, (1R,2R,4S,6R)-rel- Chemical and Physical Properties

Names and Identifiers

    • 3-Oxatricyclo[4.1.1.02,4]octane,2,7,7-trimethyl-, (1R,2R,4S,6R)-rel-
    • (1alpha,2beta,4beta,6alpha)-2,2,7-Trimethyl-3-oxatricyclo(4.1.1.02,4)octane
    • (+-)-alpha-Pinene oxide
    • EINECS 250-938-1
    • 32162-27-9
    • (1S-(1alpha,2alpha,4alpha,6alpha))-2,2,7-Trimethyl-3-oxatricyclo(4.1.1.02,4)octane
    • 3-Oxatricyclo(4.1.1.0(sup 2,4))octane, 2,7,7-trimethyl-, d-
    • EC 250-938-1
    • AKOS032437793
    • EINECS 238-617-4
    • NS00123844
    • Inchi: 1S/C10H16O/c1-9(2)6-4-7(9)10(3)8(5-6)11-10/h6-8H,4-5H2,1-3H3/t6-,7-,8+,10-/m0/s1
    • InChI Key: NQFUSWIGRKFAHK-OORONAJNSA-N
    • SMILES: O1[C@@H]2C[C@@H]3C[C@@H](C3(C)C)[C@]12C

Computed Properties

  • Exact Mass: 152.12
  • Monoisotopic Mass: 152.12
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 221
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 4
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 12.5A^2
  • XLogP3: 2.1

Experimental Properties

  • Density: 1.027
  • Boiling Point: 188.6°Cat760mmHg
  • Flash Point: 65.6°C
  • Refractive Index: 1.504
  • PSA: 12.53000
  • LogP: 2.20990
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