ChemSpider 2D Image | 1-[(Methylsulfanyl)methyl]-2-(phenylsulfanyl)benzene | C14H14S2

1-[(Methylsulfanyl)methyl]-2-(phenylsulfanyl)benzene

  • Molecular FormulaC14H14S2
  • Average mass246.391 Da
  • Monoisotopic mass246.053696 Da
  • ChemSpider ID28672383

More details:

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

1-[(Methylsulfanyl)methyl]-2-(phenylsulfanyl)benzene [ACD/IUPAC Name]
1-[(Méthylsulfanyl)méthyl]-2-(phénylsulfanyl)benzène [French] [ACD/IUPAC Name]
1-[(Methylsulfanyl)methyl]-2-(phenylsulfanyl)benzol [German] [ACD/IUPAC Name]
Benzene, 1-[(methylthio)methyl]-2-(phenylthio)- [ACD/Index Name]
112399-07-2 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 350.0±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.1±3.0 kJ/mol
Flash Point: 163.7±20.2 °C
Index of Refraction: 1.648
Molar Refractivity: 76.7±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.79
ACD/LogD (pH 5.5): 4.37
ACD/BCF (pH 5.5): 1233.95
ACD/KOC (pH 5.5): 5680.02
ACD/LogD (pH 7.4): 4.37
ACD/BCF (pH 7.4): 1233.95
ACD/KOC (pH 7.4): 5680.02
Polar Surface Area: 51 Å2
Polarizability: 30.4±0.5 10-24cm3
Surface Tension: 49.9±5.0 dyne/cm
Molar Volume: 210.9±5.0 cm3

Click to predict properties on the Chemicalize site


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