ChemSpider 2D Image | [(1E)-1-(4-Fluorophenyl)-1-penten-3-ylidene]malononitrile | C14H11FN2

[(1E)-1-(4-Fluorophenyl)-1-penten-3-ylidene]malononitrile

  • Molecular FormulaC14H11FN2
  • Average mass226.249 Da
  • Monoisotopic mass226.090622 Da
  • ChemSpider ID30657082

  • Double-bond stereo - Double-bond stereo

More details:

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

[(1E)-1-(4-Fluorophenyl)-1-penten-3-ylidene]malononitrile [ACD/IUPAC Name]
[(1E)-1-(4-Fluorophényl)-1-pentén-3-ylidène]malononitrile [French] [ACD/IUPAC Name]
[(1E)-1-(4-Fluorphenyl)-1-penten-3-yliden]malononitril [German] [ACD/IUPAC Name]
Propanedinitrile, 2-[(2E)-1-ethyl-3-(4-fluorophenyl)-2-propen-1-ylidene]- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 380.8±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.9±3.0 kJ/mol
Flash Point: 184.1±26.5 °C
Index of Refraction: 1.572
Molar Refractivity: 64.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.86
ACD/LogD (pH 5.5): 2.91
ACD/BCF (pH 5.5): 96.10
ACD/KOC (pH 5.5): 913.81
ACD/LogD (pH 7.4): 2.91
ACD/BCF (pH 7.4): 96.10
ACD/KOC (pH 7.4): 913.81
Polar Surface Area: 48 Å2
Polarizability: 25.7±0.5 10-24cm3
Surface Tension: 45.7±3.0 dyne/cm
Molar Volume: 197.1±3.0 cm3

Click to predict properties on the Chemicalize site


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