ChemSpider 2D Image | (3beta,5alpha,6beta,11beta,23E)-Cholest-23-ene-3,5,6,11-tetrol | C27H46O4

(3β,5α,6β,11β,23E)-Cholest-23-ene-3,5,6,11-tetrol

  • Molecular FormulaC27H46O4
  • Average mass434.652 Da
  • Monoisotopic mass434.339600 Da
  • ChemSpider ID44210995

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 11 of 11 defined stereocentres

More details:

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

(3β,5α,6β,11β,23E)-Cholest-23-en-3,5,6,11-tetrol [German] [ACD/IUPAC Name]
(3β,5α,6β,11β,23E)-Cholest-23-ene-3,5,6,11-tetrol [ACD/IUPAC Name]
(3β,5α,6β,11β,23E)-Cholest-23-ène-3,5,6,11-tétrol [French] [ACD/IUPAC Name]
Cholest-23-ene-3,5,6,11-tetrol, (3β,5α,6β,11β,23E)- [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: 547.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 95.1±6.0 kJ/mol
Flash Point: 228.6±24.7 °C
Index of Refraction: 1.562
Molar Refractivity: 125.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.44
ACD/LogD (pH 5.5): 3.90
ACD/BCF (pH 5.5): 541.28
ACD/KOC (pH 5.5): 3149.12
ACD/LogD (pH 7.4): 3.90
ACD/BCF (pH 7.4): 541.28
ACD/KOC (pH 7.4): 3149.12
Polar Surface Area: 81 Å2
Polarizability: 49.6±0.5 10-24cm3
Surface Tension: 49.0±3.0 dyne/cm
Molar Volume: 385.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement