ChemSpider 2D Image | 4,4',4''-(Benzene-1,3,5-triyltricarbonyl)tribenzonitrile | C30H15N3O3

4,4',4''-(Benzene-1,3,5-triyltricarbonyl)tribenzonitrile

  • Molecular FormulaC30H15N3O3
  • Average mass465.458 Da
  • Monoisotopic mass465.111328 Da
  • ChemSpider ID21142004

More details:

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

4,4',4''-(Benzene-1,3,5-triyltricarbonyl)tribenzonitrile [ACD/IUPAC Name]
4,4',4''-(Benzène-1,3,5-triyltricarbonyl)tribenzonitrile [French] [ACD/IUPAC Name]
4,4',4''-(Benzol-1,3,5-triyltricarbonyl)tribenzonitril [German] [ACD/IUPAC Name]
Benzonitrile, 4,4',4''-(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: 750.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 109.4±3.0 kJ/mol
Flash Point: 407.8±32.9 °C
Index of Refraction: 1.694
Molar Refractivity: 128.8±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.89
ACD/LogD (pH 5.5): 4.32
ACD/BCF (pH 5.5): 1124.51
ACD/KOC (pH 5.5): 5314.69
ACD/LogD (pH 7.4): 4.32
ACD/BCF (pH 7.4): 1124.51
ACD/KOC (pH 7.4): 5314.69
Polar Surface Area: 123 Å2
Polarizability: 51.1±0.5 10-24cm3
Surface Tension: 79.1±5.0 dyne/cm
Molar Volume: 335.4±5.0 cm3

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