ChemSpider 2D Image | (3beta)-9,14-Dimethylcholest-5-en-3-yl hydrogen sulfate | C29H50O4S

(3β)-9,14-Dimethylcholest-5-en-3-yl hydrogen sulfate

  • Molecular FormulaC29H50O4S
  • Average mass494.770 Da
  • Monoisotopic mass494.342987 Da
  • ChemSpider ID34533071

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(3β)-9,14-Dimethylcholest-5-en-3-yl hydrogen sulfate [ACD/IUPAC Name]
(3β)-9,14-Dimethylcholest-5-en-3-ylhydrogensulfat [German] [ACD/IUPAC Name]
Cholest-5-en-3-ol, 9,14-dimethyl-, hydrogen sulfate, (3β)- [ACD/Index Name]
Hydrogénosulfate de (3β)-9,14-diméthylcholest-5-én-3-yle [French] [ACD/IUPAC 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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.536
Molar Refractivity: 139.9±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 11.10
ACD/LogD (pH 5.5): 5.58
ACD/BCF (pH 5.5): 1492.01
ACD/KOC (pH 5.5): 658.64
ACD/LogD (pH 7.4): 5.58
ACD/BCF (pH 7.4): 1492.01
ACD/KOC (pH 7.4): 658.64
Polar Surface Area: 72 Å2
Polarizability: 55.4±0.5 10-24cm3
Surface Tension: 43.3±5.0 dyne/cm
Molar Volume: 448.2±5.0 cm3

Click to predict properties on the Chemicalize site


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