ChemSpider 2D Image | Cholestane-3,7,12,24,26-pentol | C27H48O5

Cholestane-3,7,12,24,26-pentol

  • Molecular FormulaC27H48O5
  • Average mass452.667 Da
  • Monoisotopic mass452.350189 Da
  • ChemSpider ID28575968

More details:

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

Cholestan-3,7,12,24,26-pentol [German] [ACD/IUPAC Name]
Cholestane-3,7,12,24,26-pentol [ACD/Index Name] [ACD/IUPAC Name]
Cholestane-3,7,12,24,26-pentol [French] [ACD/Index Name] [ACD/IUPAC Name]
401798-22-9 [RN]
CHOLESTANE-3,7,12,24,26-PENTOL, (3A,5B,7A,12A,24S)-

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

Density: 1.1±0.1 g/cm3
Boiling Point: 621.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.1 mmHg at 25°C
Enthalpy of Vaporization: 105.6±6.0 kJ/mol
Flash Point: 263.6±26.1 °C
Index of Refraction: 1.553
Molar Refractivity: 126.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 5
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 2.56
ACD/LogD (pH 5.5): 2.45
ACD/BCF (pH 5.5): 42.62
ACD/KOC (pH 5.5): 510.57
ACD/LogD (pH 7.4): 2.45
ACD/BCF (pH 7.4): 42.61
ACD/KOC (pH 7.4): 510.57
Polar Surface Area: 101 Å2
Polarizability: 50.2±0.5 10-24cm3
Surface Tension: 49.5±3.0 dyne/cm
Molar Volume: 395.5±3.0 cm3

Click to predict properties on the Chemicalize site


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