ChemSpider 2D Image | N-[2-Fluoro-5-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)phenyl]-5-oxoprolinamide | C16H20FN3O4

N-[2-Fluoro-5-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)phenyl]-5-oxoprolinamide

  • Molecular FormulaC16H20FN3O4
  • Average mass337.346 Da
  • Monoisotopic mass337.143799 Da
  • ChemSpider ID30306317

More details:

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

Carbamic acid, N-[4-fluoro-3-[[(5-oxo-2-pyrrolidinyl)carbonyl]amino]phenyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
N-[2-Fluor-5-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)phenyl]-5-oxoprolinamid [German] [ACD/IUPAC Name]
N-[2-Fluoro-5-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)phenyl]-5-oxoprolinamide [ACD/IUPAC Name]
N-[2-Fluoro-5-({[(2-méthyl-2-propanyl)oxy]carbonyl}amino)phényl]-5-oxoprolinamide [French] [ACD/IUPAC Name]
TERT-BUTYL N-[4-FLUORO-3-(5-OXOPYRROLIDINE-2-AMIDO)PHENYL]CARBAMATE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 530.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.6±3.0 kJ/mol
Flash Point: 274.6±30.1 °C
Index of Refraction: 1.591
Molar Refractivity: 85.6±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.26
ACD/LogD (pH 5.5): 0.85
ACD/BCF (pH 5.5): 2.61
ACD/KOC (pH 5.5): 69.07
ACD/LogD (pH 7.4): 0.85
ACD/BCF (pH 7.4): 2.61
ACD/KOC (pH 7.4): 69.07
Polar Surface Area: 97 Å2
Polarizability: 33.9±0.5 10-24cm3
Surface Tension: 57.0±3.0 dyne/cm
Molar Volume: 253.1±3.0 cm3

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