ChemSpider 2D Image | GLYCERYL 1,2-ISODISTEARATE | C39H76O5

GLYCERYL 1,2-ISODISTEARATE

  • Molecular FormulaC39H76O5
  • Average mass625.018 Da
  • Monoisotopic mass624.569275 Da
  • ChemSpider ID2298923

More details:

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

286430-02-2 [RN]
3-Hydroxy-1,2-propandiyl-bis(16-methylheptadecanoat) [German] [ACD/IUPAC Name]
3-Hydroxy-1,2-propanediyl bis(16-methylheptadecanoate) [ACD/IUPAC Name]
Bis(16-méthylheptadécanoate) de 3-hydroxy-1,2-propanediyle [French] [ACD/IUPAC Name]
GLYCERYL 1,2-ISODISTEARATE
Heptadecanoic acid, 16-methyl-, 1-(hydroxymethyl)-1,2-ethanediyl ester [ACD/Index Name]
1-HYDROXY-3-[(16-METHYLHEPTADECANOYL)OXY]PROPAN-2-YL 16-METHYLHEPTADECANOATE
273-368-5 [EINECS]
68958-48-5 [RN]
Di(isooctadecanoic) acid, diester with glycerol
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

NB2IRE6N4K [DBID]
UNII:NB2IRE6N4K [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: 656.6±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.5 mmHg at 25°C
Enthalpy of Vaporization: 110.7±6.0 kJ/mol
Flash Point: 179.7±15.8 °C
Index of Refraction: 1.466
Molar Refractivity: 187.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 36
#Rule of 5 Violations: 2
ACD/LogP: 16.10
ACD/LogD (pH 5.5): 13.24
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 13.24
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 73 Å2
Polarizability: 74.4±0.5 10-24cm3
Surface Tension: 34.4±3.0 dyne/cm
Molar Volume: 677.9±3.0 cm3

Click to predict properties on the Chemicalize site


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