ChemSpider 2D Image | 2-(4-Bromophenyl)-5,7-dimethyl-3-(methylsulfanyl)-1-benzofuran | C17H15BrOS

2-(4-Bromophenyl)-5,7-dimethyl-3-(methylsulfanyl)-1-benzofuran

  • Molecular FormulaC17H15BrOS
  • Average mass347.269 Da
  • Monoisotopic mass346.002686 Da
  • ChemSpider ID21119525

More details:

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

2-(4-Bromophenyl)-5,7-dimethyl-3-(methylsulfanyl)-1-benzofuran [ACD/IUPAC Name]
2-(4-Bromophényl)-5,7-diméthyl-3-(méthylsulfanyl)-1-benzofurane [French] [ACD/IUPAC Name]
2-(4-Bromphenyl)-5,7-dimethyl-3-(methylsulfanyl)-1-benzofuran [German] [ACD/IUPAC Name]
Benzofuran, 2-(4-bromophenyl)-5,7-dimethyl-3-(methylthio)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 454.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 68.7±3.0 kJ/mol
Flash Point: 228.7±28.7 °C
Index of Refraction: 1.680
Molar Refractivity: 91.1±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 7.09
ACD/LogD (pH 5.5): 6.24
ACD/BCF (pH 5.5): 32306.52
ACD/KOC (pH 5.5): 58794.11
ACD/LogD (pH 7.4): 6.24
ACD/BCF (pH 7.4): 32306.52
ACD/KOC (pH 7.4): 58794.11
Polar Surface Area: 38 Å2
Polarizability: 36.1±0.5 10-24cm3
Surface Tension: 54.8±5.0 dyne/cm
Molar Volume: 241.0±5.0 cm3

Click to predict properties on the Chemicalize site


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