ChemSpider 2D Image | (3beta)-Cholest-5-en-3-yl (10,10,10-~2~H_3_)decanoate | C37H61D3O2

(3β)-Cholest-5-en-3-yl (10,10,10-2H3)decanoate

  • Molecular FormulaC37H61D3O2
  • Average mass543.921 Da
  • Monoisotopic mass543.509460 Da
  • ChemSpider ID58781542

  • defined stereocentres - 8 of 8 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(10,10,10-2H3)Décanoate de (3β)-cholest-5-én-3-yle [French] [ACD/IUPAC Name]
(3β)-Cholest-5-en-3-yl (10,10,10-2H3)decanoate [ACD/IUPAC Name]
(3β)-Cholest-5-en-3-yl-(10,10,10-2H3)decanoat [German] [ACD/IUPAC Name]
Decanoic-10,10,10-d3 acid, (3β)-cholest-5-en-3-yl 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: 587.5±29.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.7±3.0 kJ/mol
Flash Point: 307.8±11.8 °C
Index of Refraction: 1.509
Molar Refractivity: 166.6±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 2
ACD/LogP: 14.95
ACD/LogD (pH 5.5): 13.64
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 13.64
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 26 Å2
Polarizability: 66.0±0.5 10-24cm3
Surface Tension: 37.7±5.0 dyne/cm
Molar Volume: 558.0±5.0 cm3

Click to predict properties on the Chemicalize site


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