ChemSpider 2D Image | (3S,3aR,4aS,8aS,9aS)-3,8a-Dimethyl-5-methylenedecahydronaphtho[2,3-b]furan-2(3H)-one | C15H22O2

(3S,3aR,4aS,8aS,9aS)-3,8a-Dimethyl-5-methylenedecahydronaphtho[2,3-b]furan-2(3H)-one

  • Molecular FormulaC15H22O2
  • Average mass234.334 Da
  • Monoisotopic mass234.161987 Da
  • ChemSpider ID66424786

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(3S,3aR,4aS,8aS,9aS)-3,8a-Dimethyl-5-methylendecahydronaphtho[2,3-b]furan-2(3H)-on [German] [ACD/IUPAC Name]
(3S,3aR,4aS,8aS,9aS)-3,8a-Dimethyl-5-methylenedecahydronaphtho[2,3-b]furan-2(3H)-one [ACD/IUPAC Name]
(3S,3aR,4aS,8aS,9aS)-3,8a-Diméthyl-5-méthylènedécahydronaphto[2,3-b]furan-2(3H)-one [French] [ACD/IUPAC Name]
Naphtho[2,3-b]furan-2(3H)-one, decahydro-3,8a-dimethyl-5-methylene-, (3S,3aR,4aS,8aS,9aS)- [ACD/Index Name]
dihydroisoalantolactone

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

Density: 1.1±0.1 g/cm3
Boiling Point: 354.8±41.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.0±3.0 kJ/mol
Flash Point: 148.0±25.0 °C
Index of Refraction: 1.516
Molar Refractivity: 66.7±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.51
ACD/LogD (pH 5.5): 3.60
ACD/BCF (pH 5.5): 322.00
ACD/KOC (pH 5.5): 2171.36
ACD/LogD (pH 7.4): 3.60
ACD/BCF (pH 7.4): 322.00
ACD/KOC (pH 7.4): 2171.36
Polar Surface Area: 26 Å2
Polarizability: 26.4±0.5 10-24cm3
Surface Tension: 36.1±5.0 dyne/cm
Molar Volume: 220.9±5.0 cm3

Click to predict properties on the Chemicalize site


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