ChemSpider 2D Image | Tris(6-methylheptyl) citrate | C30H56O7

Tris(6-methylheptyl) citrate

  • Molecular FormulaC30H56O7
  • Average mass528.761 Da
  • Monoisotopic mass528.402588 Da
  • ChemSpider ID13341656

More details:

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

1,2,3-Propanetricarboxylic acid, 2-hydroxy-, tris(6-methylheptyl) ester [ACD/Index Name]
Citrate de tris(6-méthylheptyle) [French] [ACD/IUPAC Name]
Tris(6-methylheptyl) citrate [ACD/IUPAC Name]
Tris(6-methylheptyl)citrat [German] [ACD/IUPAC Name]
triisooctyl citrate

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

Density: 1.0±0.1 g/cm3
Boiling Point: 537.1±17.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 93.6±6.0 kJ/mol
Flash Point: 151.8±14.4 °C
Index of Refraction: 1.467
Molar Refractivity: 147.7±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 26
#Rule of 5 Violations: 2
ACD/LogP: 10.51
ACD/LogD (pH 5.5): 9.09
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 2102563.50
ACD/LogD (pH 7.4): 9.09
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 2102293.50
Polar Surface Area: 99 Å2
Polarizability: 58.6±0.5 10-24cm3
Surface Tension: 35.8±3.0 dyne/cm
Molar Volume: 532.9±3.0 cm3

Click to predict properties on the Chemicalize site


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