ChemSpider 2D Image | MFCD17015254 | C2713C18H76O2

MFCD17015254

  • Molecular FormulaC2713C18H76O2
  • Average mass666.951 Da
  • Monoisotopic mass666.644897 Da
  • ChemSpider ID58824705

  • Double-bond stereo - Double-bond stereo

    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

(3β)-Cholest-5-en-3-yl (9Z,12Z)-(13C18)-9,12-octadecadienoate [ACD/IUPAC Name]
(3β)-Cholest-5-en-3-yl-(9Z,12Z)-(13C18)-9,12-octadecadienoat [German] [ACD/IUPAC Name]
(9Z,12Z)-(13C18)-9,12-Octadécadiénoate de (3β)-cholest-5-én-3-yle [French] [ACD/IUPAC Name]
9,12-Octadecadienoic-1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18-13C18 acid, (3β)-cholest-5-en-3-yl ester, (9Z,12Z)- [ACD/Index Name]
MFCD17015254

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

Density: 1.0±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.517
Molar Refractivity: 203.5±0.4 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 80.7±0.5 10-24cm3
Surface Tension: 38.7±5.0 dyne/cm
Molar Volume: 672.9±5.0 cm3

Click to predict properties on the Chemicalize site


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