ChemSpider 2D Image | 5-Cyclohexyl-3-[(4-fluorophenyl)sulfonyl]-2-methyl-1-benzofuran | C21H21FO3S

5-Cyclohexyl-3-[(4-fluorophenyl)sulfonyl]-2-methyl-1-benzofuran

  • Molecular FormulaC21H21FO3S
  • Average mass372.453 Da
  • Monoisotopic mass372.119537 Da
  • ChemSpider ID30656594

More details:

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

5-Cyclohexyl-3-[(4-fluorophenyl)sulfonyl]-2-methyl-1-benzofuran [ACD/IUPAC Name]
5-Cyclohexyl-3-[(4-fluorophényl)sulfonyl]-2-méthyl-1-benzofurane [French] [ACD/IUPAC Name]
5-Cyclohexyl-3-[(4-fluorphenyl)sulfonyl]-2-methyl-1-benzofuran [German] [ACD/IUPAC Name]
Benzofuran, 5-cyclohexyl-3-[(4-fluorophenyl)sulfonyl]-2-methyl- [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: 533.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 77.9±3.0 kJ/mol
Flash Point: 276.4±30.1 °C
Index of Refraction: 1.595
Molar Refractivity: 100.8±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 6.33
ACD/LogD (pH 5.5): 5.45
ACD/BCF (pH 5.5): 8187.66
ACD/KOC (pH 5.5): 22010.52
ACD/LogD (pH 7.4): 5.45
ACD/BCF (pH 7.4): 8187.66
ACD/KOC (pH 7.4): 22010.52
Polar Surface Area: 56 Å2
Polarizability: 39.9±0.5 10-24cm3
Surface Tension: 45.5±3.0 dyne/cm
Molar Volume: 296.4±3.0 cm3

Click to predict properties on the Chemicalize site


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