ChemSpider 2D Image | (1aS,4aR,7S,7aR,7bS)-1a,7,7b-Trimethyl-4-methylenedecahydro-1H-cyclopropa[e]azulen-7-ol | C15H24O

(1aS,4aR,7S,7aR,7bS)-1a,7,7b-Trimethyl-4-methylenedecahydro-1H-cyclopropa[e]azulen-7-ol

  • Molecular FormulaC15H24O
  • Average mass220.350 Da
  • Monoisotopic mass220.182709 Da
  • ChemSpider ID30783274

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(1aS,4aR,7S,7aR,7bS)-1a,7,7b-Trimethyl-4-methylendecahydro-1H-cyclopropa[e]azulen-7-ol [German] [ACD/IUPAC Name]
(1aS,4aR,7S,7aR,7bS)-1a,7,7b-Trimethyl-4-methylenedecahydro-1H-cyclopropa[e]azulen-7-ol [ACD/IUPAC Name]
(1aS,4aR,7S,7aR,7bS)-1a,7,7b-Triméthyl-4-méthylènedécahydro-1H-cyclopropa[e]azulén-7-ol [French] [ACD/IUPAC Name]
1H-Cycloprop[e]azulen-7-ol, decahydro-1a,7,7b-trimethyl-4-methylene-, (1aS,4aR,7S,7aR,7bS)- [ACD/Index Name]
[6750-60-3] [RN]
6750-60-3 [RN]
MFCD17214859
spathulenol

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

Density: 1.0±0.1 g/cm3
Boiling Point: 289.1±19.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 61.3±6.0 kJ/mol
Flash Point: 121.6±13.7 °C
Index of Refraction: 1.531
Molar Refractivity: 66.4±0.4 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 4.38
ACD/LogD (pH 5.5): 4.13
ACD/BCF (pH 5.5): 814.92
ACD/KOC (pH 5.5): 4220.64
ACD/LogD (pH 7.4): 4.13
ACD/BCF (pH 7.4): 814.92
ACD/KOC (pH 7.4): 4220.64
Polar Surface Area: 20 Å2
Polarizability: 26.3±0.5 10-24cm3
Surface Tension: 36.9±5.0 dyne/cm
Molar Volume: 214.8±5.0 cm3

Click to predict properties on the Chemicalize site


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