ChemSpider 2D Image | Trilauryl citrate | C42H80O7

Trilauryl citrate

  • Molecular FormulaC42H80O7
  • Average mass697.080 Da
  • Monoisotopic mass696.590393 Da
  • ChemSpider ID2285286

More details:






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

1,2,3-Propanetricarboxylic acid, 2-hydroxy-, tridodecyl ester [ACD/Index Name]
1,2,3-Tridodecyl 2-hydroxy-1,2,3-propanetricarboxylate
265-671-6 [EINECS]
65277-53-4 [RN]
Citrate de tridodécyle [French] [ACD/IUPAC Name]
Citric acid, tridodecyl ester
Tridodecyl citrate [ACD/IUPAC Name]
Tridodecylcitrat [German] [ACD/IUPAC Name]
Trilauryl citrate
1,2,3-tridodecyl 2-hydroxypropane-1,2,3-tricarboxylate
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

OW111W8S5O [DBID]
UNII:OW111W8S5O [DBID]
UNII-OW111W8S5O [DBID]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 675.9±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.7 mmHg at 25°C
Enthalpy of Vaporization: 113.5±6.0 kJ/mol
Flash Point: 179.6±15.8 °C
Index of Refraction: 1.470
Molar Refractivity: 203.5±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 41
#Rule of 5 Violations: 2
ACD/LogP: 17.43
ACD/LogD (pH 5.5): 16.63
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 16.63
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 99 Å2
Polarizability: 80.7±0.5 10-24cm3
Surface Tension: 36.1±3.0 dyne/cm
Molar Volume: 729.8±3.0 cm3

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