ChemSpider 2D Image | [2-(Methylsulfanyl)phenyl](3-thienyl)methanone | C12H10OS2

[2-(Methylsulfanyl)phenyl](3-thienyl)methanone

  • Molecular FormulaC12H10OS2
  • Average mass234.337 Da
  • Monoisotopic mass234.017303 Da
  • ChemSpider ID21398088

More details:

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

[2-(Methylsulfanyl)phenyl](3-thienyl)methanon [German] [ACD/IUPAC Name]
[2-(Methylsulfanyl)phenyl](3-thienyl)methanone [ACD/IUPAC Name]
[2-(Méthylsulfanyl)phényl](3-thiényl)méthanone [French] [ACD/IUPAC Name]
Methanone, [2-(methylthio)phenyl]-3-thienyl- [ACD/Index Name]
(2-methylsulfanylphenyl)-thiophen-3-ylmethanone
[2-(Methylsulfanyl)phenyl](thiophen-3-yl)methanone
3-(2-thiomethylbenzoyl)thiophene
896618-53-4 [RN]
MFCD07699018 [MDL number]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 387.8±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.7±3.0 kJ/mol
Flash Point: 188.4±22.3 °C
Index of Refraction: 1.648
Molar Refractivity: 67.0±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.54
ACD/LogD (pH 5.5): 3.57
ACD/BCF (pH 5.5): 306.38
ACD/KOC (pH 5.5): 2095.42
ACD/LogD (pH 7.4): 3.57
ACD/BCF (pH 7.4): 306.38
ACD/KOC (pH 7.4): 2095.42
Polar Surface Area: 71 Å2
Polarizability: 26.6±0.5 10-24cm3
Surface Tension: 53.7±5.0 dyne/cm
Molar Volume: 184.1±5.0 cm3

Click to predict properties on the Chemicalize site


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