ChemSpider 2D Image | 2,3-Bis(hexanoyloxy)propyl stearate | C33H62O6

2,3-Bis(hexanoyloxy)propyl stearate

  • Molecular FormulaC33H62O6
  • Average mass554.842 Da
  • Monoisotopic mass554.454651 Da
  • ChemSpider ID57506265

More details:

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

2,3-Bis(hexanoyloxy)propyl stearate [ACD/IUPAC Name]
2,3-Bis(hexanoyloxy)propylstearat [German] [ACD/IUPAC Name]
Octadecanoic acid, 2,3-bis[(1-oxohexyl)oxy]propyl ester [ACD/Index Name]
Stéarate de 2,3-bis(hexanoyloxy)propyle [French] [ACD/IUPAC Name]
2,3-BIS(HEXANOYLOXY)PROPYL OCTADECANOATE
56149-04-3 [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: 578.6±17.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.6±3.0 kJ/mol
Flash Point: 233.3±21.0 °C
Index of Refraction: 1.461
Molar Refractivity: 160.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 32
#Rule of 5 Violations: 2
ACD/LogP: 12.52
ACD/LogD (pH 5.5): 12.29
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 12.29
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: 34.6±3.0 dyne/cm
Molar Volume: 584.1±3.0 cm3

Click to predict properties on the Chemicalize site


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