ChemSpider 2D Image | (3beta,4alpha,5beta,10alpha,14beta)-3,4-Epoxycholestane | C27H46O

(3β,4α,5β,10α,14β)-3,4-Epoxycholestane

  • Molecular FormulaC27H46O
  • Average mass386.654 Da
  • Monoisotopic mass386.354858 Da
  • ChemSpider ID62653807

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

(3α,4α,5α,8α,9β,14β)-3,4-Epoxycholestan [German] [ACD/IUPAC Name]
(3α,4α,5α,8α,9β,14β)-3,4-Epoxycholestane [ACD/IUPAC Name]
(3α,4α,5α,8α,9β,14β)-3,4-Époxycholestane [French] [ACD/IUPAC Name]
(3β,4α,5β,10α,14β)-3,4-Epoxycholestan [German] [ACD/IUPAC Name]
(3β,4α,5β,10α,14β)-3,4-Epoxycholestane [ACD/IUPAC Name]
(3β,4α,5β,10α,14β)-3,4-Époxycholestane [French] [ACD/IUPAC Name]
Cholestane, 3,4-epoxy-, (3α,4α,5α,8α,9β,14β)- [ACD/Index Name]
Cholestane, 3,4-epoxy-, (3β,4α,5β,10α,14β)- [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: 432.4±13.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.2±3.0 kJ/mol
Flash Point: 181.3±16.7 °C
Index of Refraction: 1.505
Molar Refractivity: 118.4±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 10.12
ACD/LogD (pH 5.5): 8.69
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1268551.75
ACD/LogD (pH 7.4): 8.69
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1268551.75
Polar Surface Area: 13 Å2
Polarizability: 46.9±0.5 10-24cm3
Surface Tension: 33.4±3.0 dyne/cm
Molar Volume: 399.0±3.0 cm3

Click to predict properties on the Chemicalize site


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