ChemSpider 2D Image | 2,3-Bis(decanoyloxy)propyl 10-methyldodecanoate | C36H68O6

2,3-Bis(decanoyloxy)propyl 10-methyldodecanoate

  • Molecular FormulaC36H68O6
  • Average mass596.922 Da
  • Monoisotopic mass596.501587 Da
  • ChemSpider ID59673478

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

10-Méthyldodécanoate de 2,3-bis(decanoyloxy)propyle [French] [ACD/IUPAC Name]
2,3-Bis(decanoyloxy)propyl 10-methyldodecanoate [ACD/IUPAC Name]
2,3-Bis(decanoyloxy)propyl-10-methyldodecanoat [German] [ACD/IUPAC Name]
Dodecanoic acid, 10-methyl-, 2,3-bis[(1-oxodecyl)oxy]propyl ester [ACD/Index Name]
(2S)-2,3-bis(decanoyloxy)propyl 10-methyldodecanoate
TG(10:0/10:0/a-13:0)[rac]

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

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

Density: 0.9±0.1 g/cm3
Boiling Point: 608.7±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.4±3.0 kJ/mol
Flash Point: 242.6±22.4 °C
Index of Refraction: 1.461
Molar Refractivity: 174.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 34
#Rule of 5 Violations: 2
ACD/LogP: 13.93
ACD/LogD (pH 5.5): 13.26
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 13.26
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 79 Å2
Polarizability: 69.0±0.5 10-24cm3
Surface Tension: 34.2±3.0 dyne/cm
Molar Volume: 634.0±3.0 cm3

Click to predict properties on the Chemicalize site


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