ChemSpider 2D Image | {3-[(3-Ethynylphenyl)ethynyl]benzylidene}malononitrile | C20H10N2

{3-[(3-Ethynylphenyl)ethynyl]benzylidene}malononitrile

  • Molecular FormulaC20H10N2
  • Average mass278.307 Da
  • Monoisotopic mass278.084412 Da
  • ChemSpider ID85499566

More details:

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

{3-[(3-Ethinylphenyl)ethinyl]benzyliden}malononitril [German] [ACD/IUPAC Name]
{3-[(3-Ethynylphenyl)ethynyl]benzylidene}malononitrile [ACD/IUPAC Name]
{3-[(3-Éthynylphényl)éthynyl]benzylidène}malononitrile [French] [ACD/IUPAC Name]
Propanedinitrile, 2-[[3-[2-(3-ethynylphenyl)ethynyl]phenyl]methylene]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 504.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.4±3.0 kJ/mol
Flash Point: 244.4±24.0 °C
Index of Refraction: 1.653
Molar Refractivity: 83.9±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.72
ACD/LogD (pH 5.5): 4.51
ACD/BCF (pH 5.5): 1581.15
ACD/KOC (pH 5.5): 6783.02
ACD/LogD (pH 7.4): 4.51
ACD/BCF (pH 7.4): 1581.15
ACD/KOC (pH 7.4): 6783.02
Polar Surface Area: 48 Å2
Polarizability: 33.3±0.5 10-24cm3
Surface Tension: 66.4±5.0 dyne/cm
Molar Volume: 229.0±5.0 cm3

Click to predict properties on the Chemicalize site


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