ChemSpider 2D Image | 4,4'-{(2,2-Dimethyl-1,3-propanediyl)bis[nitrilo(E)methylylidene]}dibenzonitrile | C21H20N4

4,4'-{(2,2-Dimethyl-1,3-propanediyl)bis[nitrilo(E)methylylidene]}dibenzonitrile

  • Molecular FormulaC21H20N4
  • Average mass328.410 Da
  • Monoisotopic mass328.168793 Da
  • ChemSpider ID24740268

  • Double-bond stereo - Double-bond stereo

More details:

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

4,4'-{(2,2-Dimethyl-1,3-propandiyl)bis[nitrilo(E)methylyliden]}dibenzonitril [German] [ACD/IUPAC Name]
4,4'-{(2,2-Dimethyl-1,3-propanediyl)bis[nitrilo(E)methylylidene]}dibenzonitrile [ACD/IUPAC Name]
4,4'-{(2,2-Diméthyl-1,3-propanediyl)bis[nitrilo(E)méthylylidène]}dibenzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 4,4'-[(2,2-dimethyl-1,3-propanediyl)bis[nitrilo(E)methylidyne]]bis- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 516.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.9±3.0 kJ/mol
Flash Point: 266.2±28.7 °C
Index of Refraction: 1.565
Molar Refractivity: 104.3±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.60
ACD/LogD (pH 5.5): 3.82
ACD/BCF (pH 5.5): 461.69
ACD/KOC (pH 5.5): 2768.04
ACD/LogD (pH 7.4): 3.84
ACD/BCF (pH 7.4): 486.61
ACD/KOC (pH 7.4): 2917.46
Polar Surface Area: 72 Å2
Polarizability: 41.4±0.5 10-24cm3
Surface Tension: 40.8±7.0 dyne/cm
Molar Volume: 320.2±7.0 cm3

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