ChemSpider 2D Image | Ethyl 2,3-dimethyl-4H-thieno[3,2-c]thiopyran-6-carboxylate | C12H14O2S2

Ethyl 2,3-dimethyl-4H-thieno[3,2-c]thiopyran-6-carboxylate

  • Molecular FormulaC12H14O2S2
  • Average mass254.368 Da
  • Monoisotopic mass254.043518 Da
  • ChemSpider ID29204329

More details:

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

2,3-Diméthyl-4H-thiéno[3,2-c]thiopyrane-6-carboxylate d'éthyle [French] [ACD/IUPAC Name]
4H-Thieno[3,2-c]thiopyran-6-carboxylic acid, 2,3-dimethyl-, ethyl ester [ACD/Index Name]
Ethyl 2,3-dimethyl-4H-thieno[3,2-c]thiopyran-6-carboxylate [ACD/IUPAC Name]
Ethyl-2,3-dimethyl-4H-thieno[3,2-c]thiopyran-6-carboxylat [German] [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: 402.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.4±3.0 kJ/mol
Flash Point: 197.5±28.7 °C
Index of Refraction: 1.603
Molar Refractivity: 69.8±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.32
ACD/LogD (pH 5.5): 3.78
ACD/BCF (pH 5.5): 441.45
ACD/KOC (pH 5.5): 2721.52
ACD/LogD (pH 7.4): 3.78
ACD/BCF (pH 7.4): 441.45
ACD/KOC (pH 7.4): 2721.52
Polar Surface Area: 80 Å2
Polarizability: 27.7±0.5 10-24cm3
Surface Tension: 48.4±3.0 dyne/cm
Molar Volume: 203.2±3.0 cm3

Click to predict properties on the Chemicalize site


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