ChemSpider 2D Image | 2-(Cyanomethyl)-5-[(4-ethynylphenyl)ethynyl]benzonitrile | C19H10N2

2-(Cyanomethyl)-5-[(4-ethynylphenyl)ethynyl]benzonitrile

  • Molecular FormulaC19H10N2
  • Average mass266.296 Da
  • Monoisotopic mass266.084412 Da
  • ChemSpider ID84644450

More details:

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

2-(Cyanmethyl)-5-[(4-ethinylphenyl)ethinyl]benzonitril [German] [ACD/IUPAC Name]
2-(Cyanomethyl)-5-[(4-ethynylphenyl)ethynyl]benzonitrile [ACD/IUPAC Name]
2-(Cyanométhyl)-5-[(4-éthynylphényl)éthynyl]benzonitrile [French] [ACD/IUPAC Name]
Benzeneacetonitrile, 2-cyano-4-[2-(4-ethynylphenyl)ethynyl]- [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: 461.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.2±3.0 kJ/mol
Flash Point: 220.7±22.6 °C
Index of Refraction: 1.646
Molar Refractivity: 79.6±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.63
ACD/LogD (pH 5.5): 3.67
ACD/BCF (pH 5.5): 365.72
ACD/KOC (pH 5.5): 2378.51
ACD/LogD (pH 7.4): 3.67
ACD/BCF (pH 7.4): 365.72
ACD/KOC (pH 7.4): 2378.51
Polar Surface Area: 48 Å2
Polarizability: 31.5±0.5 10-24cm3
Surface Tension: 67.4±5.0 dyne/cm
Molar Volume: 219.2±5.0 cm3

Click to predict properties on the Chemicalize site


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