Cas no 114175-89-2 (3,7-dimethyldeca-3,7-diene)

3,7-dimethyldeca-3,7-diene structure
3,7-dimethyldeca-3,7-diene structure
Product Name:3,7-dimethyldeca-3,7-diene
CAS No:114175-89-2
MF:C12H22
MW:166.303083896637
CID:2612452
PubChem ID:59837131
Update Time:2025-04-21

3,7-dimethyldeca-3,7-diene Chemical and Physical Properties

Names and Identifiers

    • 3,7-dimethyldeca-3,7-diene
    • 114175-89-2
    • DTXSID70733156
    • Inchi: 1S/C12H22/c1-5-8-12(4)10-7-9-11(3)6-2/h8-9H,5-7,10H2,1-4H3
    • InChI Key: KQVWODVOTACJRM-UHFFFAOYSA-N
    • SMILES: C(C(C)=CCC)CC=C(C)CC

Computed Properties

  • Exact Mass: 166.172150702Da
  • Monoisotopic Mass: 166.172150702Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 5
  • Complexity: 161
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 2
  • XLogP3: 5
  • Topological Polar Surface Area: 0?2
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