ChemSpider 2D Image | 4alpha-hydroxymethyl-5alpha-cholest-8-en-3beta-ol | C28H48O2

4α-hydroxymethyl-5α-cholest-8-en-3β-ol

  • Molecular FormulaC28H48O2
  • Average mass416.680 Da
  • Monoisotopic mass416.365417 Da
  • ChemSpider ID24850086

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(3β,4α,5α)-4-(Hydroxymethyl)cholest-8-en-3-ol [ACD/IUPAC Name]
(3β,4α,5α)-4-(Hydroxymethyl)cholest-8-en-3-ol [German] [ACD/IUPAC Name]
(3β,4α,5α)-4-(Hydroxyméthyl)cholest-8-én-3-ol [French] [ACD/IUPAC Name]
4α-hydroxymethyl-5α-cholest-8-en-3β-ol
Cholest-8-en-3-ol, 4-(hydroxymethyl)-, (3β,4α,5α)- [ACD/Index Name]
(3β,4α,5α)-4-(hydroxymethyl)cholest-8-en-3-ol; 4α-(hydroxymethyl)-5α-cholest-8-en-3β-ol
4&α;-hydroxymethyl-5&α;-cholesta-8-en-3&β;-ol
4α-hydroxymethyl-5α-cholesta-8-en-3β-ol

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

Density: 1.0±0.1 g/cm3
Boiling Point: 523.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 91.7±6.0 kJ/mol
Flash Point: 215.7±24.7 °C
Index of Refraction: 1.535
Molar Refractivity: 125.9±0.4 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 8.64
ACD/LogD (pH 5.5): 7.80
ACD/BCF (pH 5.5): 500679.38
ACD/KOC (pH 5.5): 418134.91
ACD/LogD (pH 7.4): 7.80
ACD/BCF (pH 7.4): 500679.38
ACD/KOC (pH 7.4): 418134.91
Polar Surface Area: 40 Å2
Polarizability: 49.9±0.5 10-24cm3
Surface Tension: 41.4±5.0 dyne/cm
Molar Volume: 404.7±5.0 cm3

Click to predict properties on the Chemicalize site


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