ChemSpider 2D Image | TRIMETHYLOLPROPANE TRINONANOATE | C33H62O6

TRIMETHYLOLPROPANE TRINONANOATE

  • Molecular FormulaC33H62O6
  • Average mass554.842 Da
  • Monoisotopic mass554.454651 Da
  • ChemSpider ID29084

More details:

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

126-57-8 [RN]
2,2-Bis[(nonanoyloxy)methyl]butyl nonanoate [ACD/IUPAC Name]
2,2-bis[(nonanoyloxy)methyl]butyl nonanoate (non-preferred name)
2,2-Bis[(nonanoyloxy)methyl]butyl-nonanoat [German] [ACD/IUPAC Name]
204-793-6 [EINECS]
2-Ethyl-2-(((1-oxononyl)oxy)methyl)propane-1,3-diyl dinonan- 1-oate
Nonanoate de 2,2-bis[(nonanoyloxy)méthyl]butyle [French] [ACD/IUPAC Name]
Nonanoic acid, 2-ethyl-2-[[(1-oxononyl)oxy]methyl]-1,3-propanediyl ester
TRIMETHYLOLPROPANE TRINONANOATE
Trimethylolpropane tripelargonate
More...

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

LYU05M4EOA [DBID]
UNII:LYU05M4EOA [DBID]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 598.4±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.1±3.0 kJ/mol
Flash Point: 241.9±24.6 °C
Index of Refraction: 1.461
Molar Refractivity: 160.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 31
#Rule of 5 Violations: 2
ACD/LogP: 12.10
ACD/LogD (pH 5.5): 11.85
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 11.85
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 79 Å2
Polarizability: 63.5±0.5 10-24cm3
Surface Tension: 34.5±3.0 dyne/cm
Molar Volume: 583.8±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement