ChemSpider 2D Image | 3-[(4-Methoxybenzyl)oxy]cholest-5-ene | C35H54O2

3-[(4-Methoxybenzyl)oxy]cholest-5-ene

  • Molecular FormulaC35H54O2
  • Average mass506.802 Da
  • Monoisotopic mass506.412384 Da
  • ChemSpider ID9310083

  • defined stereocentres - 7 of 8 defined stereocentres

More details:

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

3-[(4-Methoxybenzyl)oxy]cholest-5-en [German] [ACD/IUPAC Name]
3-[(4-Methoxybenzyl)oxy]cholest-5-ene [ACD/IUPAC Name]
3-[(4-Méthoxybenzyl)oxy]cholest-5-ène [French] [ACD/IUPAC Name]
Cholest-5-ene, 3-[(4-methoxyphenyl)methoxy]- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 577.5±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.2±3.0 kJ/mol
Flash Point: 161.6±26.3 °C
Index of Refraction: 1.541
Molar Refractivity: 155.9±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 12.48
ACD/LogD (pH 5.5): 10.65
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 10.65
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 18 Å2
Polarizability: 61.8±0.5 10-24cm3
Surface Tension: 40.1±5.0 dyne/cm
Molar Volume: 496.4±5.0 cm3

Click to predict properties on the Chemicalize site


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