ChemSpider 2D Image | (3beta,24S)-Cholest-5-ene-3,24-diyl bis(hydrogen sulfate) | C27H46O8S2

(3β,24S)-Cholest-5-ene-3,24-diyl bis(hydrogen sulfate)

  • Molecular FormulaC27H46O8S2
  • Average mass562.779 Da
  • Monoisotopic mass562.263428 Da
  • ChemSpider ID64808451
  • defined stereocentres - 9 of 9 defined stereocentres


More details:






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

(3β,24S)-Cholest-5-en-3,24-diylbis(hydrogensulfat) [German] [ACD/IUPAC Name]
(3β,24S)-Cholest-5-ene-3,24-diyl bis(hydrogen sulfate) [ACD/IUPAC Name]
Bis(hydrogénosulfate) de (3β,24S)-cholest-5-ène-3,24-diyle [French] [ACD/IUPAC Name]
Cholest-5-ene-3,24-diol, bis(hydrogen sulfate), (3β,24S)- [ACD/Index Name]
(24S)-hydroxycholesterol 3,24-disulfate
(3β,24S)-cholest-5-ene-3,24-diyl bis(hydrogen sulfate); 24-OHChol-3,24-disulfate

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.563
Molar Refractivity: 142.6±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 8.22
ACD/LogD (pH 5.5): -1.35
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.35
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 144 Å2
Polarizability: 56.5±0.5 10-24cm3
Surface Tension: 53.6±5.0 dyne/cm
Molar Volume: 439.1±5.0 cm3

Click to predict properties on the Chemicalize site






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