ChemSpider 2D Image | (1R,2S,7S,10S,12S)-2,6,6-Trimethyl-13-methylenetetracyclo[10.3.1.0~1,10~.0~2,7~]hexadecane | C20H32

(1R,2S,7S,10S,12S)-2,6,6-Trimethyl-13-methylenetetracyclo[10.3.1.01,10.02,7]hexadecane

  • Molecular FormulaC20H32
  • Average mass272.468 Da
  • Monoisotopic mass272.250397 Da
  • ChemSpider ID21865698

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(1R,2S,7S,10S,12S)-2,6,6-Trimethyl-13-methylenetetracyclo[10.3.1.01,10.02,7]hexadecane [ACD/IUPAC Name]
(1R,2S,7S,10S,12S)-2,6,6-Triméthyl-13-méthylènetétracyclo[10.3.1.01,10.02,7]hexadécane [French] [ACD/IUPAC Name]
(1R,2S,7S,10S,12S)-2,6,6-Trimethyl-13-methylentetracyclo[10.3.1.01,10.02,7]hexadecan [German] [ACD/IUPAC Name]
(4aS,6aS,8S,11aR,11bS)-Tetradecahydro-4,4,11b-trimethyl-9-methylene-8,11a-methano-11aH-cyclohepta[a]naphthalene
8,11a-Methano-11aH-cyclohepta[a]naphthalene, tetradecahydro-4,4,11b-trimethyl-9-methylene-, (4aS,6aS,8S,11aR,11bS)- [ACD/Index Name]
929635-55-2 [RN]
(4aS,6aS,8S,11aR,11bS)-4,4,11b-trimethyl-9-methylenetetradecahydro-8,11a-methanocyclohepta[a]naphthalene
(4aS,6aS,8S,11aR,11bS)-4,4,11b-trimethyl-9-methylidenetetradecahydro-8,11a-methanocyclohepta[a]naphthalene
exo-stemodene
exo-stemodene|syn-stemodene|syn-stemod-13(17)-ene|stemod-13(17)-ene
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point: 346.9±9.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.4 mmHg at 25°C
Enthalpy of Vaporization: 56.8±0.8 kJ/mol
Flash Point: 170.3±6.3 °C
Index of Refraction: 1.525
Molar Refractivity: 86.0±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 1
ACD/LogP: 8.47
ACD/LogD (pH 5.5): 7.31
ACD/BCF (pH 5.5): 210593.44
ACD/KOC (pH 5.5): 224955.97
ACD/LogD (pH 7.4): 7.31
ACD/BCF (pH 7.4): 210593.44
ACD/KOC (pH 7.4): 224955.97
Polar Surface Area: 0 Å2
Polarizability: 34.1±0.5 10-24cm3
Surface Tension: 34.8±5.0 dyne/cm
Molar Volume: 280.6±5.0 cm3

Click to predict properties on the Chemicalize site


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