ChemSpider 2D Image | (4aS,5R,8aR)-1,1,4a-Trimethyl-6-methylene-5-(3-methylene-4-penten-1-yl)decahydronaphthalene | C20H32

(4aS,5R,8aR)-1,1,4a-Trimethyl-6-methylene-5-(3-methylene-4-penten-1-yl)decahydronaphthalene

  • Molecular FormulaC20H32
  • Average mass272.468 Da
  • Monoisotopic mass272.250397 Da
  • ChemSpider ID67030179
  • defined stereocentres - 3 of 3 defined stereocentres


More details:






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

(4aS,5R,8aR)-1,1,4a-Trimethyl-6-methylen-5-(3-methylen-4-penten-1-yl)decahydronaphthalin [German] [ACD/IUPAC Name]
(4aS,5R,8aR)-1,1,4a-Triméthyl-6-méthylène-5-(3-méthylène-4-pentén-1-yl)décahydronaphtalène [French] [ACD/IUPAC Name]
(4aS,5R,8aR)-1,1,4a-Trimethyl-6-methylene-5-(3-methylene-4-penten-1-yl)decahydronaphthalene [ACD/IUPAC Name]
Naphthalene, decahydro-1,1,4a-trimethyl-6-methylene-5-(3-methylene-4-penten-1-yl)-, (4aS,5R,8aR)- [ACD/Index Name]
sclarene

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

Density: 0.9±0.1 g/cm3
Boiling Point: 337.8±9.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 55.8±0.8 kJ/mol
Flash Point: 152.2±13.6 °C
Index of Refraction: 1.493
Molar Refractivity: 89.4±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 8.71
ACD/LogD (pH 5.5): 7.27
ACD/BCF (pH 5.5): 198833.72
ACD/KOC (pH 5.5): 215891.09
ACD/LogD (pH 7.4): 7.27
ACD/BCF (pH 7.4): 198833.72
ACD/KOC (pH 7.4): 215891.09
Polar Surface Area: 0 Å2
Polarizability: 35.4±0.5 10-24cm3
Surface Tension: 30.1±5.0 dyne/cm
Molar Volume: 307.6±5.0 cm3

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