Cas no 40319-81-1 (Bicyclo[3.2.2]non-2-ene)

Bicyclo[3.2.2]non-2-ene structure
Bicyclo[3.2.2]non-2-ene structure
Product Name:Bicyclo[3.2.2]non-2-ene
CAS No:40319-81-1
MF:C9H14
MW:122.207462787628
CID:333869
PubChem ID:142429
Update Time:2025-04-19

Bicyclo[3.2.2]non-2-ene Chemical and Physical Properties

Names and Identifiers

    • Bicyclo[3.2.2]non-2-ene
    • bicyclo[3.2.2]non-3-ene
    • Bicyclo(3.2.2)non-2-ene
    • DTXSID40193324
    • 40319-81-1
    • Inchi: 1S/C9H14/c1-2-8-4-6-9(3-1)7-5-8/h1-2,8-9H,3-7H2
    • InChI Key: BCCQOAANWUKEPI-UHFFFAOYSA-N
    • SMILES: C12CC=CC(CC1)CC2

Computed Properties

  • Exact Mass: 122.10962
  • Monoisotopic Mass: 122.11
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 0
  • Complexity: 116
  • 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: 3.4
  • Topological Polar Surface Area: 0?2

Experimental Properties

  • Density: 0.912
  • Boiling Point: 164.4°Cat760mmHg
  • Flash Point: 37.8°C
  • Refractive Index: 1.496
  • PSA: 0
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