ChemSpider 2D Image | 3,3',3''-(Benzene-1,3,5-triyltricarbonyl)tribenzoic acid | C30H18O9

3,3',3''-(Benzene-1,3,5-triyltricarbonyl)tribenzoic acid

  • Molecular FormulaC30H18O9
  • Average mass522.458 Da
  • Monoisotopic mass522.095093 Da
  • ChemSpider ID30653615

More details:

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

3,3',3''-(Benzene-1,3,5-triyltricarbonyl)tribenzoic acid [ACD/IUPAC Name]
3,3',3''-(Benzol-1,3,5-triyltricarbonyl)tribenzoesäure [German] [ACD/IUPAC Name]
Acide 3,3',3''-(benzène-1,3,5-triyltricarbonyl)tribenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 3,3',3''-(benzene-1,3,5-triyltricarbonyl)tris- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 861.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 131.2±3.0 kJ/mol
Flash Point: 488.6±30.8 °C
Index of Refraction: 1.679
Molar Refractivity: 136.4±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 5.78
ACD/LogD (pH 5.5): 0.50
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 163 Å2
Polarizability: 54.1±0.5 10-24cm3
Surface Tension: 72.0±3.0 dyne/cm
Molar Volume: 361.4±3.0 cm3

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