ChemSpider 2D Image | MFCD00042879 | C63H122O6

MFCD00042879

  • Molecular FormulaC63H122O6
  • Average mass975.639 Da
  • Monoisotopic mass974.924133 Da
  • ChemSpider ID455365

More details:

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

1,2,3-Propanetriol trieicosanoate
1,2,3-Propanetriyl triicosanoate [ACD/IUPAC Name]
1,2,3-Propantriyl-triicosanoat [German] [ACD/IUPAC Name]
1,2,3-Triarachidoyl Glycerol
1,3-bis(icosanoyloxy)propan-2-yl icosanoate
2,3-Bis(icosanoyloxy)propyl icosanoate
210-646-7 [EINECS]
620-64-4 [RN]
Eicosanoic acid, 1,2,3-propanetriyl ester [ACD/Index Name]
MFCD00042879
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

48RPR95FW8 [DBID]
90601_FLUKA [DBID]
EPA Pesticide Chemical Code 079011 [DBID]
LMGL03010003 [DBID]
T9267_SIGMA [DBID]
UNII:48RPR95FW8 [DBID]
UNII-48RPR95FW8 [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: 863.6±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 125.5±3.0 kJ/mol
Flash Point: 311.1±25.2 °C
Index of Refraction: 1.467
Molar Refractivity: 299.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 62
#Rule of 5 Violations: 2
ACD/LogP: 28.45
ACD/LogD (pH 5.5): 26.78
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 26.78
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 79 Å2
Polarizability: 118.6±0.5 10-24cm3
Surface Tension: 34.2±3.0 dyne/cm
Molar Volume: 1079.3±3.0 cm3

Click to predict properties on the Chemicalize site


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