ChemSpider 2D Image | (2R)-1,2-Propanediyl dioctadecanoate | C39H76O4

(2R)-1,2-Propanediyl dioctadecanoate

  • Molecular FormulaC39H76O4
  • Average mass609.018 Da
  • Monoisotopic mass608.574341 Da
  • ChemSpider ID34992411

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-1,2-Propandiyl-dioctadecanoat [German] [ACD/IUPAC Name]
(2R)-1,2-Propanediyl dioctadecanoate [ACD/IUPAC Name]
Dioctadécanoate de (2R)-1,2-propanediyle [French] [ACD/IUPAC Name]
Octadecanoic acid, (1R)-1-methyl-2-[(1-oxooctadecyl)oxy]ethyl ester [ACD/Index Name]
228-229-3 [EINECS]
6182-11-2 [RN]
PROPYLENE GLYCOL 1,2-DISTEARATE
Propylene glycol stearate
UNII-MZM1I680W0
UNII-T65PN3O37H

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

Density: 0.9±0.1 g/cm3
Boiling Point: 640.5±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.6±3.0 kJ/mol
Flash Point: 301.2±22.4 °C
Index of Refraction: 1.460
Molar Refractivity: 186.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 37
#Rule of 5 Violations: 2
ACD/LogP: 17.30
ACD/LogD (pH 5.5): 16.14
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 16.14
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 53 Å2
Polarizability: 73.8±0.5 10-24cm3
Surface Tension: 33.1±3.0 dyne/cm
Molar Volume: 679.6±3.0 cm3

Click to predict properties on the Chemicalize site


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