ChemSpider 2D Image | Methyl 3-(methylsulfinyl)-2-thiophenecarboxylate | C7H8O3S2

Methyl 3-(methylsulfinyl)-2-thiophenecarboxylate

  • Molecular FormulaC7H8O3S2
  • Average mass204.267 Da
  • Monoisotopic mass203.991486 Da
  • ChemSpider ID57453835

More details:

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

2-Thiophenecarboxylic acid, 3-(methylsulfinyl)-, methyl ester [ACD/Index Name]
3-(Méthylsulfinyl)-2-thiophènecarboxylate de méthyle [French] [ACD/IUPAC Name]
62353-78-0 [RN]
Methyl 3-(methylsulfinyl)-2-thiophenecarboxylate [ACD/IUPAC Name]
Methyl-3-(methylsulfinyl)-2-thiophencarboxylat [German] [ACD/IUPAC Name]
Methyl 3-(methanesulfinyl)thiophene-2-carboxylate

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

Density: 1.4±0.1 g/cm3
Boiling Point: 386.0±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.5±3.0 kJ/mol
Flash Point: 187.3±23.7 °C
Index of Refraction: 1.609
Molar Refractivity: 49.5±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.13
ACD/LogD (pH 5.5): 1.22
ACD/BCF (pH 5.5): 4.96
ACD/KOC (pH 5.5): 109.46
ACD/LogD (pH 7.4): 1.22
ACD/BCF (pH 7.4): 4.96
ACD/KOC (pH 7.4): 109.46
Polar Surface Area: 91 Å2
Polarizability: 19.6±0.5 10-24cm3
Surface Tension: 64.6±5.0 dyne/cm
Molar Volume: 143.0±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement