ChemSpider 2D Image | ({4-[2-(2,5-Dimethyl-3-thienyl)-3,3,4,4,5,5-hexafluoro-1-cyclopenten-1-yl]-5-methyl-2-thienyl}methylene)malononitrile | C20H12F6N2S2

({4-[2-(2,5-Dimethyl-3-thienyl)-3,3,4,4,5,5-hexafluoro-1-cyclopenten-1-yl]-5-methyl-2-thienyl}methylene)malononitrile

  • Molecular FormulaC20H12F6N2S2
  • Average mass458.443 Da
  • Monoisotopic mass458.034607 Da
  • ChemSpider ID21128278

More details:

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

({4-[2-(2,5-Dimethyl-3-thienyl)-3,3,4,4,5,5-hexafluor-1-cyclopenten-1-yl]-5-methyl-2-thienyl}methylen)malononitril [German] [ACD/IUPAC Name]
({4-[2-(2,5-Dimethyl-3-thienyl)-3,3,4,4,5,5-hexafluoro-1-cyclopenten-1-yl]-5-methyl-2-thienyl}methylene)malononitrile [ACD/IUPAC Name]
({4-[2-(2,5-Diméthyl-3-thiényl)-3,3,4,4,5,5-hexafluoro-1-cyclopentén-1-yl]-5-méthyl-2-thiényl}méthylène)malononitrile [French] [ACD/IUPAC Name]
Propanedinitrile, 2-[[4-[2-(2,5-dimethyl-3-thienyl)-3,3,4,4,5,5-hexafluoro-1-cyclopenten-1-yl]-5-methyl-2-thienyl]methylene]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 493.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.1±3.0 kJ/mol
Flash Point: 252.5±28.7 °C
Index of Refraction: 1.564
Molar Refractivity: 101.0±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.84
ACD/LogD (pH 5.5): 5.57
ACD/BCF (pH 5.5): 10084.60
ACD/KOC (pH 5.5): 25551.05
ACD/LogD (pH 7.4): 5.57
ACD/BCF (pH 7.4): 10084.60
ACD/KOC (pH 7.4): 25551.05
Polar Surface Area: 104 Å2
Polarizability: 40.0±0.5 10-24cm3
Surface Tension: 48.2±5.0 dyne/cm
Molar Volume: 310.4±5.0 cm3

Click to predict properties on the Chemicalize site


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