ChemSpider 2D Image | kunzeaol | C15H26O

kunzeaol

  • Molecular FormulaC15H26O
  • Average mass222.366 Da
  • Monoisotopic mass222.198364 Da
  • ChemSpider ID28639117

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(1R,2E,6E,10R)-10-Isopropyl-3,7-dimethyl-2,6-cyclodecadien-1-ol [German] [ACD/IUPAC Name]
(1R,2E,6E,10R)-10-Isopropyl-3,7-dimethyl-2,6-cyclodecadien-1-ol [ACD/IUPAC Name]
(1R,2E,6E,10R)-10-Isopropyl-3,7-diméthyl-2,6-cyclodécadién-1-ol [French] [ACD/IUPAC Name]
2,6-Cyclodecadien-1-ol, 3,7-dimethyl-10-(1-methylethyl)-, (1R,2E,6E,10R)- [ACD/Index Name]
kunzeaol
(1R,2E,6E,10R)-10-isopropyl-3,7-dimethylcyclodeca-2,6-dien-1-ol
6&β;-hydroxygermacra-1(10),4-diene
6β-hydroxygermacra-1(10),4-diene
  • Miscellaneous

    • Chemical Class:

      A germacrane sesquiterpenoid derived from germacrane by dehydrogenation between the 1-10 and 4-5 positions as well as hydroxylation at position 6. ChEBI CHEBI:72776

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 0.9±0.1 g/cm3
Boiling Point: 320.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 65.1±6.0 kJ/mol
Flash Point: 134.7±20.1 °C
Index of Refraction: 1.476
Molar Refractivity: 70.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: 5.35
ACD/LogD (pH 5.5): 4.74
ACD/BCF (pH 5.5): 2369.57
ACD/KOC (pH 5.5): 9061.19
ACD/LogD (pH 7.4): 4.74
ACD/BCF (pH 7.4): 2369.57
ACD/KOC (pH 7.4): 9061.19
Polar Surface Area: 20 Å2
Polarizability: 27.8±0.5 10-24cm3
Surface Tension: 29.4±3.0 dyne/cm
Molar Volume: 249.1±3.0 cm3

Click to predict properties on the Chemicalize site


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