ChemSpider 2D Image | 3-[(4-Fluorophenyl)sulfonyl]-5-isopropyl-2-methyl-1-benzofuran | C18H17FO3S

3-[(4-Fluorophenyl)sulfonyl]-5-isopropyl-2-methyl-1-benzofuran

  • Molecular FormulaC18H17FO3S
  • Average mass332.389 Da
  • Monoisotopic mass332.088257 Da
  • ChemSpider ID24744849

More details:

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

3-[(4-Fluorophenyl)sulfonyl]-5-isopropyl-2-methyl-1-benzofuran [ACD/IUPAC Name]
3-[(4-Fluorophényl)sulfonyl]-5-isopropyl-2-méthyl-1-benzofurane [French] [ACD/IUPAC Name]
3-[(4-Fluorphenyl)sulfonyl]-5-isopropyl-2-methyl-1-benzofuran [German] [ACD/IUPAC Name]
Benzofuran, 3-[(4-fluorophenyl)sulfonyl]-2-methyl-5-(1-methylethyl)- [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: 468.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.2±3.0 kJ/mol
Flash Point: 236.9±28.7 °C
Index of Refraction: 1.585
Molar Refractivity: 88.9±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.15
ACD/LogD (pH 5.5): 4.73
ACD/BCF (pH 5.5): 2306.84
ACD/KOC (pH 5.5): 8888.82
ACD/LogD (pH 7.4): 4.73
ACD/BCF (pH 7.4): 2306.84
ACD/KOC (pH 7.4): 8888.82
Polar Surface Area: 56 Å2
Polarizability: 35.2±0.5 10-24cm3
Surface Tension: 43.0±3.0 dyne/cm
Molar Volume: 265.3±3.0 cm3

Click to predict properties on the Chemicalize site


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