ChemSpider 2D Image | Trimethylolethane trilaurate | C41H78O6

Trimethylolethane trilaurate

  • Molecular FormulaC41H78O6
  • Average mass667.054 Da
  • Monoisotopic mass666.579834 Da
  • ChemSpider ID95393

More details:






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

267-448-9 [EINECS]
2-Methyl-2-(((1-oxododecyl)oxy)methyl)propane-1,3-diyl dilaurate
3-(Dodecanoyloxy)-2-[(dodecanoyloxy)methyl]-2-methylpropyl laurate [ACD/IUPAC Name]
3-(Dodecanoyloxy)-2-[(dodecanoyloxy)methyl]-2-methylpropyllaurat [German] [ACD/IUPAC Name]
dodecanoic acid, 2-methyl-3-[(1-oxododecyl)oxy]-2-[[(1-oxododecyl)oxy]methyl]propyl ester
Laurate de 3-(dodecanoyloxy)-2-[(dodecanoyloxy)méthyl]-2-méthylpropyle [French] [ACD/IUPAC Name]
Trimethylolethane trilaurate
2-methyl-2-[[(1-oxododecyl)oxy]methyl]propane-1,3-diyl dilaurate
3-(DODECANOYLOXY)-2-[(DODECANOYLOXY)METHYL]-2-METHYLPROPYL DODECANOATE
67873-95-4 [RN]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 0.9±0.1 g/cm3
Boiling Point: 681.5±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.0±3.0 kJ/mol
Flash Point: 267.0±26.0 °C
Index of Refraction: 1.463
Molar Refractivity: 197.3±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 39
#Rule of 5 Violations: 2
ACD/LogP: 16.35
ACD/LogD (pH 5.5): 16.08
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 16.08
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 79 Å2
Polarizability: 78.2±0.5 10-24cm3
Surface Tension: 34.3±3.0 dyne/cm
Molar Volume: 715.8±3.0 cm3

Click to predict properties on the Chemicalize site






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