ChemSpider 2D Image | {(1R,4aS,5R,8aS)-1,4a-Dimethyl-6-methylene-5-[(2E)-3-methyl-2,4-pentadien-1-yl]decahydro-1-naphthalenyl}methanol | C20H32O

{(1R,4aS,5R,8aS)-1,4a-Dimethyl-6-methylene-5-[(2E)-3-methyl-2,4-pentadien-1-yl]decahydro-1-naphthalenyl}methanol

  • Molecular FormulaC20H32O
  • Average mass288.467 Da
  • Monoisotopic mass288.245331 Da
  • ChemSpider ID113601306

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 4 defined stereocentres

More details:

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

{(1R,4aS,5R,8aS)-1,4a-Dimethyl-6-methylen-5-[(2E)-3-methyl-2,4-pentadien-1-yl]decahydro-1-naphthalinyl}methanol [German] [ACD/IUPAC Name]
{(1R,4aS,5R,8aS)-1,4a-Diméthyl-6-méthylène-5-[(2E)-3-méthyl-2,4-pentadién-1-yl]décahydro-1-naphtalényl}méthanol [French] [ACD/IUPAC Name]
{(1R,4aS,5R,8aS)-1,4a-Dimethyl-6-methylene-5-[(2E)-3-methyl-2,4-pentadien-1-yl]decahydro-1-naphthalenyl}methanol [ACD/IUPAC Name]
1-Naphthalenemethanol, decahydro-1,4a-dimethyl-6-methylene-5-[(2E)-3-methyl-2,4-pentadien-1-yl]-, (1R,4aS,5R,8aS)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 380.4±11.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 72.7±6.0 kJ/mol
Flash Point: 126.6±15.6 °C
Index of Refraction: 1.513
Molar Refractivity: 91.1±0.4 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 6.71
ACD/LogD (pH 5.5): 5.76
ACD/BCF (pH 5.5): 14051.55
ACD/KOC (pH 5.5): 32398.81
ACD/LogD (pH 7.4): 5.76
ACD/BCF (pH 7.4): 14051.55
ACD/KOC (pH 7.4): 32398.81
Polar Surface Area: 20 Å2
Polarizability: 36.1±0.5 10-24cm3
Surface Tension: 34.8±5.0 dyne/cm
Molar Volume: 303.1±5.0 cm3

Click to predict properties on the Chemicalize site


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