ChemSpider 2D Image | 4-({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)-2-[(2,2,2-trifluoroethyl)amino]butanoic acid | C11H19F3N2O4

4-({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)-2-[(2,2,2-trifluoroethyl)amino]butanoic acid

  • Molecular FormulaC11H19F3N2O4
  • Average mass300.275 Da
  • Monoisotopic mass300.129700 Da
  • ChemSpider ID67972761

More details:

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

4-({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)-2-[(2,2,2-trifluorethyl)amino]butansäure [German] [ACD/IUPAC Name]
4-({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)-2-[(2,2,2-trifluoroethyl)amino]butanoic acid [ACD/IUPAC Name]
Acide 4-({[(2-méthyl-2-propanyl)oxy]carbonyl}amino)-2-[(2,2,2-trifluoroéthyl)amino]butanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 4-[[(1,1-dimethylethoxy)carbonyl]amino]-2-[(2,2,2-trifluoroethyl)amino]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 390.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 70.3±6.0 kJ/mol
Flash Point: 190.0±27.9 °C
Index of Refraction: 1.440
Molar Refractivity: 63.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 2.42
ACD/LogD (pH 5.5): -0.07
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.69
ACD/LogD (pH 7.4): -1.64
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 88 Å2
Polarizability: 25.3±0.5 10-24cm3
Surface Tension: 34.5±3.0 dyne/cm
Molar Volume: 242.7±3.0 cm3

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