ChemSpider 2D Image | 16-Acetoxy-3,11-dihydroxy-4,8,14-trimethyl-18-norcholest-24-en-21-oic acid | C31H50O6

16-Acetoxy-3,11-dihydroxy-4,8,14-trimethyl-18-norcholest-24-en-21-oic acid

  • Molecular FormulaC31H50O6
  • Average mass518.725 Da
  • Monoisotopic mass518.360718 Da
  • ChemSpider ID4425338

More details:

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

16-Acetoxy-3,11-dihydroxy-4,8,14-trimethyl-18-norcholest-24-en-21-oic acid [ACD/IUPAC Name]
16-Acetoxy-3,11-dihydroxy-4,8,14-trimethyl-18-norcholest-24-en-21-säure [German] [ACD/IUPAC Name]
5-Heptenoic acid, 2-[16-(acetyloxy)-3,11-dihydroxy-4,8,10,14-tetramethylgonan-17-yl]-6-methyl- [ACD/Index Name]
Acide 16-acétoxy-3,11-dihydroxy-4,8,14-triméthyl-18-norcholest-24-én-21-oïque [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: 626.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.1 mmHg at 25°C
Enthalpy of Vaporization: 106.2±6.0 kJ/mol
Flash Point: 193.2±25.0 °C
Index of Refraction: 1.548
Molar Refractivity: 143.5±0.4 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 5.91
ACD/LogD (pH 5.5): 4.58
ACD/BCF (pH 5.5): 1069.80
ACD/KOC (pH 5.5): 2795.70
ACD/LogD (pH 7.4): 2.78
ACD/BCF (pH 7.4): 16.83
ACD/KOC (pH 7.4): 43.99
Polar Surface Area: 104 Å2
Polarizability: 56.9±0.5 10-24cm3
Surface Tension: 48.2±5.0 dyne/cm
Molar Volume: 451.6±5.0 cm3

Click to predict properties on the Chemicalize site


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