ChemSpider 2D Image | Stereumin J | C15H24O4

Stereumin J

  • Molecular FormulaC15H24O4
  • Average mass268.349 Da
  • Monoisotopic mass268.167450 Da
  • ChemSpider ID26392461

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(1R,2aS,3S,5S,5aR,8S,8aS,8bR)-5,8-Dimethyl-2-methylendecahydro-1,2a,3,8(3H)-acenaphthylentetrol [German] [ACD/IUPAC Name]
(1R,2aS,3S,5S,5aR,8S,8aS,8bR)-5,8-Dimethyl-2-methylenedecahydro-1,2a,3,8(3H)-acenaphthylenetetrol [ACD/IUPAC Name]
(1R,2aS,3S,5S,5aR,8S,8aS,8bR)-5,8-Diméthyl-2-méthylènedécahydro-1,2a,3,8(3H)-acénaphtylènetétrol [French] [ACD/IUPAC Name]
1,2a,3,8(3H)-Acenaphthylenetetrol, decahydro-5,8-dimethyl-2-methylene-, (1R,2aS,3S,5S,5aR,8S,8aS,8bR)- [ACD/Index Name]
Stereumin J

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

Density: 1.3±0.1 g/cm3
Boiling Point: 429.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 79.0±6.0 kJ/mol
Flash Point: 203.0±23.3 °C
Index of Refraction: 1.593
Molar Refractivity: 70.9±0.4 cm3
#H bond acceptors: 4
#H bond donors: 4
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.90
ACD/LogD (pH 5.5): 0.85
ACD/BCF (pH 5.5): 2.62
ACD/KOC (pH 5.5): 69.29
ACD/LogD (pH 7.4): 0.85
ACD/BCF (pH 7.4): 2.62
ACD/KOC (pH 7.4): 69.29
Polar Surface Area: 81 Å2
Polarizability: 28.1±0.5 10-24cm3
Surface Tension: 57.6±5.0 dyne/cm
Molar Volume: 209.2±5.0 cm3

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