ChemSpider 2D Image | (3alpha,5beta)-3-Hydroxy-N-(3-hydroxypropyl)cholan-24-amide | C27H47NO3

(3α,5β)-3-Hydroxy-N-(3-hydroxypropyl)cholan-24-amide

  • Molecular FormulaC27H47NO3
  • Average mass433.667 Da
  • Monoisotopic mass433.355591 Da
  • ChemSpider ID24741842

  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

(3α,5β)-3-Hydroxy-N-(3-hydroxypropyl)cholan-24-amid [German] [ACD/IUPAC Name]
(3α,5β)-3-Hydroxy-N-(3-hydroxypropyl)cholan-24-amide [ACD/IUPAC Name]
(3α,5β)-3-Hydroxy-N-(3-hydroxypropyl)cholan-24-amide [French] [ACD/IUPAC Name]
Cholan-24-amide, 3-hydroxy-N-(3-hydroxypropyl)-, (3α,5β)- [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: 607.0±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.9 mmHg at 25°C
Enthalpy of Vaporization: 103.5±6.0 kJ/mol
Flash Point: 320.9±24.6 °C
Index of Refraction: 1.526
Molar Refractivity: 125.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.67
ACD/LogD (pH 5.5): 4.57
ACD/BCF (pH 5.5): 1761.01
ACD/KOC (pH 5.5): 7326.79
ACD/LogD (pH 7.4): 4.57
ACD/BCF (pH 7.4): 1761.01
ACD/KOC (pH 7.4): 7326.79
Polar Surface Area: 70 Å2
Polarizability: 49.8±0.5 10-24cm3
Surface Tension: 41.6±3.0 dyne/cm
Molar Volume: 409.2±3.0 cm3

Click to predict properties on the Chemicalize site


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