ChemSpider 2D Image | (20S)-5-Stigmastene-3beta,7alpha,16beta,20-tetrol | C29H50O4

(20S)-5-Stigmastene-3β,7α,16β,20-tetrol

  • Molecular FormulaC29H50O4
  • Average mass462.705 Da
  • Monoisotopic mass462.370911 Da
  • ChemSpider ID26378907

  • defined stereocentres - 11 of 11 defined stereocentres

More details:

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

(20S)-5-Stigmastene-3β,7α,16β,20-tetrol
(3β,7α,8ξ,16β)-Stigmast-5-en-3,7,16,20-tetrol [German] [ACD/IUPAC Name]
(3β,7α,8ξ,16β)-Stigmast-5-ene-3,7,16,20-tetrol [ACD/IUPAC Name]
(3β,7α,8ξ,16β)-Stigmast-5-ène-3,7,16,20-tétrol [French] [ACD/IUPAC Name]
Stigmast-5-ene-3,7,16,20-tetrol, (3β,7α,8ξ,16β)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 597.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.8 mmHg at 25°C
Enthalpy of Vaporization: 102.1±6.0 kJ/mol
Flash Point: 247.2±24.7 °C
Index of Refraction: 1.555
Molar Refractivity: 133.8±0.4 cm3
#H bond acceptors: 4
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.94
ACD/LogD (pH 5.5): 4.68
ACD/BCF (pH 5.5): 2104.83
ACD/KOC (pH 5.5): 8324.43
ACD/LogD (pH 7.4): 4.68
ACD/BCF (pH 7.4): 2104.82
ACD/KOC (pH 7.4): 8324.43
Polar Surface Area: 81 Å2
Polarizability: 53.0±0.5 10-24cm3
Surface Tension: 47.7±5.0 dyne/cm
Molar Volume: 417.1±5.0 cm3

Click to predict properties on the Chemicalize site


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