ChemSpider 2D Image | (17xi)-Spirostan-3-ol | C27H44O3

(17ξ)-Spirostan-3-ol

  • Molecular FormulaC27H44O3
  • Average mass416.637 Da
  • Monoisotopic mass416.329041 Da
  • ChemSpider ID26000174

  • defined stereocentres - 8 of 12 defined stereocentres

More details:

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

(17ξ)-Spirostan-3-ol [ACD/IUPAC Name]
(17ξ)-Spirostan-3-ol [German] [ACD/IUPAC Name]
(17ξ)-Spirostan-3-ol [French] [ACD/IUPAC Name]
Spirostan-3-ol, (17ξ)- [ACD/Index Name]
82597-74-8 [RN]
Sarsasapogenin [Wiki]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 516.6±20.0 °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: 266.2±21.8 °C
Index of Refraction: 1.552
Molar Refractivity: 119.7±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 1
ACD/LogP: 6.21
ACD/LogD (pH 5.5): 5.96
ACD/BCF (pH 5.5): 19908.36
ACD/KOC (pH 5.5): 41575.35
ACD/LogD (pH 7.4): 5.96
ACD/BCF (pH 7.4): 19908.36
ACD/KOC (pH 7.4): 41575.35
Polar Surface Area: 39 Å2
Polarizability: 47.4±0.5 10-24cm3
Surface Tension: 43.8±5.0 dyne/cm
Molar Volume: 374.3±5.0 cm3

Click to predict properties on the Chemicalize site


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