ChemSpider 2D Image | 2-Oxo-2-(1,3-thiazol-2-yl)ethyl 4-fluoro-3-(4-morpholinylsulfonyl)benzoate | C16H15FN2O6S2

2-Oxo-2-(1,3-thiazol-2-yl)ethyl 4-fluoro-3-(4-morpholinylsulfonyl)benzoate

  • Molecular FormulaC16H15FN2O6S2
  • Average mass414.428 Da
  • Monoisotopic mass414.035553 Da
  • ChemSpider ID115306026

More details:

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

2-Oxo-2-(1,3-thiazol-2-yl)ethyl 4-fluoro-3-(4-morpholinylsulfonyl)benzoate [ACD/IUPAC Name]
2-Oxo-2-(1,3-thiazol-2-yl)ethyl-4-fluor-3-(4-morpholinylsulfonyl)benzoat [German] [ACD/IUPAC Name]
4-Fluoro-3-(4-morpholinylsulfonyl)benzoate de 2-oxo-2-(1,3-thiazol-2-yl)éthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-fluoro-3-(4-morpholinylsulfonyl)-, 2-oxo-2-(2-thiazolyl)ethyl ester [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 625.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.6±3.0 kJ/mol
Flash Point: 332.0±34.3 °C
Index of Refraction: 1.598
Molar Refractivity: 94.3±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.58
ACD/LogD (pH 5.5): 1.48
ACD/BCF (pH 5.5): 7.84
ACD/KOC (pH 5.5): 151.96
ACD/LogD (pH 7.4): 1.48
ACD/BCF (pH 7.4): 7.84
ACD/KOC (pH 7.4): 151.96
Polar Surface Area: 139 Å2
Polarizability: 37.4±0.5 10-24cm3
Surface Tension: 60.6±3.0 dyne/cm
Molar Volume: 276.5±3.0 cm3

Click to predict properties on the Chemicalize site


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