ChemSpider 2D Image | 1-Methyl-4-({[(4-methylphenyl)sulfanyl]methyl}sulfinyl)benzene | C15H16OS2

1-Methyl-4-({[(4-methylphenyl)sulfanyl]methyl}sulfinyl)benzene

  • Molecular FormulaC15H16OS2
  • Average mass276.417 Da
  • Monoisotopic mass276.064270 Da
  • ChemSpider ID21416178

More details:






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

1-Methyl-4-({[(4-methylphenyl)sulfanyl]methyl}sulfinyl)benzene [ACD/IUPAC Name]
1-Méthyl-4-({[(4-méthylphényl)sulfanyl]méthyl}sulfinyl)benzène [French] [ACD/IUPAC Name]
1-Methyl-4-({[(4-methylphenyl)sulfanyl]methyl}sulfinyl)benzol [German] [ACD/IUPAC Name]
Benzene, 1-methyl-4-[[[(4-methylphenyl)sulfinyl]methyl]thio]- [ACD/Index Name]
52317-51-8 [RN]
BENZENE, 1-METHYL-4-[[[(4-METHYLPHENYL)SULFINYL]METHYL]THIO]-, (S)-

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

Density: 1.2±0.1 g/cm3
Boiling Point: 438.4±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.8±3.0 kJ/mol
Flash Point: 218.9±26.8 °C
Index of Refraction: 1.658
Molar Refractivity: 82.2±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.73
ACD/LogD (pH 5.5): 3.02
ACD/BCF (pH 5.5): 115.78
ACD/KOC (pH 5.5): 1044.11
ACD/LogD (pH 7.4): 3.02
ACD/BCF (pH 7.4): 115.78
ACD/KOC (pH 7.4): 1044.11
Polar Surface Area: 62 Å2
Polarizability: 32.6±0.5 10-24cm3
Surface Tension: 59.4±5.0 dyne/cm
Molar Volume: 223.1±5.0 cm3

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