ChemSpider 2D Image | (3beta,9beta,10alpha,13alpha,14beta,20S)-Cholest-5-en-3-yl ethyl carbonate | C30H50O3

(3β,9β,10α,13α,14β,20S)-Cholest-5-en-3-yl ethyl carbonate

  • Molecular FormulaC30H50O3
  • Average mass458.716 Da
  • Monoisotopic mass458.376007 Da
  • ChemSpider ID62642019

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(3β,9β,10α,13α,14β,17α,20S)-Cholest-5-en-3-yl ethyl carbonate [ACD/IUPAC Name]
(3β,9β,10α,13α,14β,17α,20S)-Cholest-5-en-3-yl-ethylcarbonat [German] [ACD/IUPAC Name]
(3β,9β,10α,13α,14β,20S)-Cholest-5-en-3-yl ethyl carbonate [ACD/IUPAC Name]
(3β,9β,10α,13α,14β,20S)-Cholest-5-en-3-yl-ethylcarbonat [German] [ACD/IUPAC Name]
Carbonate de (3β,9β,10α,13α,14β,17α,20S)-cholest-5-én-3-yle et d'éthyle [French] [ACD/IUPAC Name]
Carbonate de (3β,9β,10α,13α,14β,20S)-cholest-5-én-3-yle et d'éthyle [French] [ACD/IUPAC Name]
Carbonic acid, (3β,9β,10α,13α,14β,17α,20S)-cholest-5-en-3-yl ethyl ester [ACD/Index Name]
Carbonic acid, (3β,9β,10α,13α,14β,20S)-cholest-5-en-3-yl ethyl ester [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: 538.9±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.6±3.0 kJ/mol
Flash Point: 140.7±15.9 °C
Index of Refraction: 1.514
Molar Refractivity: 135.9±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 11.27
ACD/LogD (pH 5.5): 9.47
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 3355095.25
ACD/LogD (pH 7.4): 9.47
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 3355095.25
Polar Surface Area: 36 Å2
Polarizability: 53.9±0.5 10-24cm3
Surface Tension: 38.2±5.0 dyne/cm
Molar Volume: 451.3±5.0 cm3

Click to predict properties on the Chemicalize site


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