ChemSpider 2D Image | MFCD00152945 | C60H116O7

MFCD00152945

  • Molecular FormulaC60H116O7
  • Average mass949.559 Da
  • Monoisotopic mass948.872131 Da
  • ChemSpider ID22901

More details:

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

1,2,3-Propanetricarboxylic acid, 2-hydroxy-, trioctadecyl ester [ACD/Index Name]
231-896-3 [EINECS]
7775-50-0 [RN]
Citrate de trioctadécyle [French] [ACD/IUPAC Name]
Citric acid, trioctadecyl ester
MFCD00152945
Octadecyl 2-hydroxy-1,2,3-propanetricarboxylate
Octadecyl citrate
Stearyl citrate
STEARYL CITRATE TRI ESTER
More...

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

M10B5XY389 [DBID]
HSDB 1015 [DBID]
UNII:M10B5XY389 [DBID]
UNII-M10B5XY389 [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: 840.3±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 138.9±6.0 kJ/mol
Flash Point: 205.2±18.6 °C
Index of Refraction: 1.471
Molar Refractivity: 286.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 59
#Rule of 5 Violations: 2
ACD/LogP: 27.00
ACD/LogD (pH 5.5): 25.02
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 25.02
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 99 Å2
Polarizability: 113.7±0.5 10-24cm3
Surface Tension: 35.4±3.0 dyne/cm
Molar Volume: 1026.9±3.0 cm3

Click to predict properties on the Chemicalize site


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