ChemSpider 2D Image | Ethyl N-ethyl-N-{4-fluoro-3-[(methylsulfonyl)amino]benzoyl}glycinate | C14H19FN2O5S

Ethyl N-ethyl-N-{4-fluoro-3-[(methylsulfonyl)amino]benzoyl}glycinate

  • Molecular FormulaC14H19FN2O5S
  • Average mass346.375 Da
  • Monoisotopic mass346.099884 Da
  • ChemSpider ID30490318

More details:

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

Ethyl N-ethyl-N-{4-fluoro-3-[(methylsulfonyl)amino]benzoyl}glycinate [ACD/IUPAC Name]
Ethyl-N-ethyl-N-{4-fluor-3-[(methylsulfonyl)amino]benzoyl}glycinat [German] [ACD/IUPAC Name]
Glycine, N-ethyl-N-[4-fluoro-3-[(methylsulfonyl)amino]benzoyl]-, ethyl ester [ACD/Index Name]
N-Éthyl-N-{4-fluoro-3-[(méthylsulfonyl)amino]benzoyl}glycinate d'éthyle [French] [ACD/IUPAC Name]
ETHYL 2-[N-ETHYL-1-(4-FLUORO-3-METHANESULFONAMIDOPHENYL)FORMAMIDO]ACETATE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 500.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.9±3.0 kJ/mol
Flash Point: 256.5±32.9 °C
Index of Refraction: 1.548
Molar Refractivity: 82.2±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 0.65
ACD/LogD (pH 5.5): 0.94
ACD/BCF (pH 5.5): 3.04
ACD/KOC (pH 5.5): 76.49
ACD/LogD (pH 7.4): 0.47
ACD/BCF (pH 7.4): 1.02
ACD/KOC (pH 7.4): 25.72
Polar Surface Area: 101 Å2
Polarizability: 32.6±0.5 10-24cm3
Surface Tension: 50.7±3.0 dyne/cm
Molar Volume: 258.9±3.0 cm3

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