ChemSpider 2D Image | 2-Ethylhexyl 11-[(3-ethylheptanoyl)oxy]undecanoate | C28H54O4

2-Ethylhexyl 11-[(3-ethylheptanoyl)oxy]undecanoate

  • Molecular FormulaC28H54O4
  • Average mass454.726 Da
  • Monoisotopic mass454.402222 Da
  • ChemSpider ID57508019

More details:

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

11-[(3-Éthylheptanoyl)oxy]undécanoate de 2-éthylhexyle [French] [ACD/IUPAC Name]
2-Ethylhexyl 11-[(3-ethylheptanoyl)oxy]undecanoate [ACD/IUPAC Name]
2-Ethylhexyl-11-[(3-ethylheptanoyl)oxy]undecanoat [German] [ACD/IUPAC Name]
Undecanoic acid, 11-[(3-ethyl-1-oxoheptyl)oxy]-, 2-ethylhexyl ester [ACD/Index Name]
62984-43-4 [RN]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 449.4±13.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.8±3.0 kJ/mol
Flash Point: 199.5±18.2 °C
Index of Refraction: 1.455
Molar Refractivity: 135.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 25
#Rule of 5 Violations: 1
ACD/LogP: 10.92
ACD/LogD (pH 5.5): 9.52
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 3589600.25
ACD/LogD (pH 7.4): 9.52
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 3589600.25
Polar Surface Area: 53 Å2
Polarizability: 53.6±0.5 10-24cm3
Surface Tension: 32.5±3.0 dyne/cm
Molar Volume: 498.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement