ChemSpider 2D Image | 2-{[2-(Methylsulfonyl)ethyl]sulfanyl}-1-(2-thienyl)ethanone | C9H12O3S3

2-{[2-(Methylsulfonyl)ethyl]sulfanyl}-1-(2-thienyl)ethanone

  • Molecular FormulaC9H12O3S3
  • Average mass264.385 Da
  • Monoisotopic mass263.994843 Da
  • ChemSpider ID43675694

More details:

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

2-{[2-(Methylsulfonyl)ethyl]sulfanyl}-1-(2-thienyl)ethanon [German] [ACD/IUPAC Name]
2-{[2-(Methylsulfonyl)ethyl]sulfanyl}-1-(2-thienyl)ethanone [ACD/IUPAC Name]
2-{[2-(Méthylsulfonyl)éthyl]sulfanyl}-1-(2-thiényl)éthanone [French] [ACD/IUPAC Name]
Ethanone, 2-[[2-(methylsulfonyl)ethyl]thio]-1-(2-thienyl)- [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: 504.2±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.4±3.0 kJ/mol
Flash Point: 258.7±27.3 °C
Index of Refraction: 1.581
Molar Refractivity: 65.0±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.14
ACD/LogD (pH 5.5): 1.26
ACD/BCF (pH 5.5): 5.33
ACD/KOC (pH 5.5): 115.30
ACD/LogD (pH 7.4): 1.26
ACD/BCF (pH 7.4): 5.33
ACD/KOC (pH 7.4): 115.30
Polar Surface Area: 113 Å2
Polarizability: 25.8±0.5 10-24cm3
Surface Tension: 54.1±3.0 dyne/cm
Molar Volume: 195.0±3.0 cm3

Click to predict properties on the Chemicalize site


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