ChemSpider 2D Image | 1,1-Dioxidotetrahydro-3-thiophenyl 4-ethyl-5-methyl-2-thiophenecarboxylate | C12H16O4S2

1,1-Dioxidotetrahydro-3-thiophenyl 4-ethyl-5-methyl-2-thiophenecarboxylate

  • Molecular FormulaC12H16O4S2
  • Average mass288.383 Da
  • Monoisotopic mass288.049011 Da
  • ChemSpider ID62253930

More details:

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

1,1-Dioxidotetrahydro-3-thiophenyl 4-ethyl-5-methyl-2-thiophenecarboxylate [ACD/IUPAC Name]
1,1-Dioxidotetrahydro-3-thiophenyl-4-ethyl-5-methyl-2-thiophencarboxylat [German] [ACD/IUPAC Name]
2-Thiophenecarboxylic acid, 4-ethyl-5-methyl-, tetrahydro-1,1-dioxido-3-thienyl ester [ACD/Index Name]
4-Éthyl-5-méthyl-2-thiophènecarboxylate de 1,1-dioxydotétrahydro-3-thiophényle [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 499.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.8±3.0 kJ/mol
Flash Point: 256.1±28.7 °C
Index of Refraction: 1.569
Molar Refractivity: 70.5±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.14
ACD/LogD (pH 5.5): 2.21
ACD/BCF (pH 5.5): 28.36
ACD/KOC (pH 5.5): 381.46
ACD/LogD (pH 7.4): 2.21
ACD/BCF (pH 7.4): 28.36
ACD/KOC (pH 7.4): 381.46
Polar Surface Area: 97 Å2
Polarizability: 28.0±0.5 10-24cm3
Surface Tension: 52.3±5.0 dyne/cm
Molar Volume: 215.4±5.0 cm3

Click to predict properties on the Chemicalize site


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