ChemSpider 2D Image | (3beta,13xi)-24,28-Epoxystigmast-5-en-3-ol | C29H48O2

(3β,13ξ)-24,28-Epoxystigmast-5-en-3-ol

  • Molecular FormulaC29H48O2
  • Average mass428.690 Da
  • Monoisotopic mass428.365417 Da
  • ChemSpider ID58817088

  • defined stereocentres - 8 of 10 defined stereocentres

More details:

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

(3β,13ξ)-24,28-Epoxystigmast-5-en-3-ol [German] [ACD/IUPAC Name]
(3β,13ξ)-24,28-Epoxystigmast-5-en-3-ol [ACD/IUPAC Name]
(3β,13ξ)-24,28-Époxystigmast-5-én-3-ol [French] [ACD/IUPAC Name]
Stigmast-5-en-3-ol, 24,28-epoxy-, (3β,13ξ)- [ACD/Index Name]
35458-71-0 [RN]
Fucosterol epoxide

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

Density: 1.0±0.1 g/cm3
Boiling Point: 516.7±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 90.8±6.0 kJ/mol
Flash Point: 207.7±16.9 °C
Index of Refraction: 1.538
Molar Refractivity: 128.9±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 8.22
ACD/LogD (pH 5.5): 7.39
ACD/BCF (pH 5.5): 241449.78
ACD/KOC (pH 5.5): 248086.03
ACD/LogD (pH 7.4): 7.39
ACD/BCF (pH 7.4): 241449.78
ACD/KOC (pH 7.4): 248086.03
Polar Surface Area: 33 Å2
Polarizability: 51.1±0.5 10-24cm3
Surface Tension: 40.3±5.0 dyne/cm
Molar Volume: 411.9±5.0 cm3

Click to predict properties on the Chemicalize site


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