ChemSpider 2D Image | (1E,1'E,1''E)-1,1',1''-[1,2,3-Propanetriyltris(oxy)]tris(1-octadecene-1,12-diol) | C57H110O9

(1E,1'E,1''E)-1,1',1''-[1,2,3-Propanetriyltris(oxy)]tris(1-octadecene-1,12-diol)

  • Molecular FormulaC57H110O9
  • Average mass939.478 Da
  • Monoisotopic mass938.815002 Da
  • ChemSpider ID95641808

More details:

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

(1E,1'E,1''E)-1,1',1''-[1,2,3-Propanetriyltris(oxy)]tris(1-octadecene-1,12-diol) [ACD/IUPAC Name]
(1E,1'E,1''E)-1,1',1''-[1,2,3-Propanetriyltris(oxy)]tris(1-octadécène-1,12-diol) [French] [ACD/IUPAC Name]
(1E,1'E,1''E)-1,1',1''-[1,2,3-Propantriyltris(oxy)]tris(1-octadecen-1,12-diol) [German] [ACD/IUPAC Name]
1-Octadecene-1,12-diol, 1,1',1''-[1,2,3-propanetriyltris(oxy)]tris-, (1E,1'E,1''E)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 931.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 153.7±6.0 kJ/mol
Flash Point: 516.9±34.3 °C
Index of Refraction: 1.498
Molar Refractivity: 280.1±0.3 cm3
#H bond acceptors: 9
#H bond donors: 6
#Freely Rotating Bonds: 53
#Rule of 5 Violations: 3
ACD/LogP: 20.40
ACD/LogD (pH 5.5): 16.85
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 16.85
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 149 Å2
Polarizability: 111.0±0.5 10-24cm3
Surface Tension: 39.8±3.0 dyne/cm
Molar Volume: 955.3±3.0 cm3

Click to predict properties on the Chemicalize site


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