ChemSpider 2D Image | 3,5-Difluoro-4'-methyl-4-(methylsulfanyl)biphenyl | C14H12F2S

3,5-Difluoro-4'-methyl-4-(methylsulfanyl)biphenyl

  • Molecular FormulaC14H12F2S
  • Average mass250.307 Da
  • Monoisotopic mass250.062775 Da
  • ChemSpider ID117702375

More details:

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

1,1'-Biphenyl, 3,5-difluoro-4'-methyl-4-(methylthio)- [ACD/Index Name]
3,5-Difluor-4'-methyl-4-(methylsulfanyl)biphenyl [German] [ACD/IUPAC Name]
3,5-Difluoro-4'-methyl-4-(methylsulfanyl)biphenyl [ACD/IUPAC Name]
3,5-Difluoro-4'-méthyl-4-(méthylsulfanyl)biphényle [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 307.0±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.6±3.0 kJ/mol
Flash Point: 139.5±27.9 °C
Index of Refraction: 1.585
Molar Refractivity: 68.9±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.33
ACD/LogD (pH 5.5): 4.90
ACD/BCF (pH 5.5): 3116.69
ACD/KOC (pH 5.5): 11025.06
ACD/LogD (pH 7.4): 4.90
ACD/BCF (pH 7.4): 3116.69
ACD/KOC (pH 7.4): 11025.06
Polar Surface Area: 25 Å2
Polarizability: 27.3±0.5 10-24cm3
Surface Tension: 41.1±5.0 dyne/cm
Molar Volume: 205.8±5.0 cm3

Click to predict properties on the Chemicalize site


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