ChemSpider 2D Image | 2,5-Bis(4-fluorophenyl)-3-(methylsulfanyl)-1-benzofuran | C21H14F2OS

2,5-Bis(4-fluorophenyl)-3-(methylsulfanyl)-1-benzofuran

  • Molecular FormulaC21H14F2OS
  • Average mass352.397 Da
  • Monoisotopic mass352.073334 Da
  • ChemSpider ID30656615

More details:

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

2,5-Bis(4-fluorophenyl)-3-(methylsulfanyl)-1-benzofuran [ACD/IUPAC Name]
2,5-Bis(4-fluorophényl)-3-(méthylsulfanyl)-1-benzofurane [French] [ACD/IUPAC Name]
2,5-Bis(4-fluorphenyl)-3-(methylsulfanyl)-1-benzofuran [German] [ACD/IUPAC Name]
Benzofuran, 2,5-bis(4-fluorophenyl)-3-(methylthio)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 489.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 72.7±3.0 kJ/mol
Flash Point: 249.7±28.7 °C
Index of Refraction: 1.672
Molar Refractivity: 99.1±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 6.89
ACD/LogD (pH 5.5): 6.06
ACD/BCF (pH 5.5): 23714.94
ACD/KOC (pH 5.5): 47122.29
ACD/LogD (pH 7.4): 6.06
ACD/BCF (pH 7.4): 23714.94
ACD/KOC (pH 7.4): 47122.29
Polar Surface Area: 38 Å2
Polarizability: 39.3±0.5 10-24cm3
Surface Tension: 53.4±5.0 dyne/cm
Molar Volume: 264.5±5.0 cm3

Click to predict properties on the Chemicalize site


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