ChemSpider 2D Image | Ethyl 2-(tetrahydro-2H-thiopyran-4-yl)-1,3-thiazole-4-carboxylate | C11H15NO2S2

Ethyl 2-(tetrahydro-2H-thiopyran-4-yl)-1,3-thiazole-4-carboxylate

  • Molecular FormulaC11H15NO2S2
  • Average mass257.372 Da
  • Monoisotopic mass257.054413 Da
  • ChemSpider ID38775363

More details:

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

2-(Tétrahydro-2H-thiopyrane-4-yl)-1,3-thiazole-4-carboxylate d'éthyle [French] [ACD/IUPAC Name]
4-Thiazolecarboxylic acid, 2-(tetrahydro-2H-thiopyran-4-yl)-, ethyl ester [ACD/Index Name]
Ethyl 2-(tetrahydro-2H-thiopyran-4-yl)-1,3-thiazole-4-carboxylate [ACD/IUPAC Name]
Ethyl-2-(tetrahydro-2H-thiopyran-4-yl)-1,3-thiazol-4-carboxylat [German] [ACD/IUPAC Name]
955399-75-4 [RN]
Ethyl 2-(tetrahydro-2H-thiopyran-4-yl)thiazole-4-carboxylate

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

Density: 1.2±0.1 g/cm3
Boiling Point: 389.9±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.9±3.0 kJ/mol
Flash Point: 189.6±25.1 °C
Index of Refraction: 1.576
Molar Refractivity: 68.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.70
ACD/LogD (pH 5.5): 2.89
ACD/BCF (pH 5.5): 93.02
ACD/KOC (pH 5.5): 892.69
ACD/LogD (pH 7.4): 2.89
ACD/BCF (pH 7.4): 93.02
ACD/KOC (pH 7.4): 892.70
Polar Surface Area: 93 Å2
Polarizability: 27.2±0.5 10-24cm3
Surface Tension: 50.0±3.0 dyne/cm
Molar Volume: 207.2±3.0 cm3

Click to predict properties on the Chemicalize site


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