ChemSpider 2D Image | 2-Methyl-3-(methyl{[2-(2,2,2-trifluoroethoxy)-4-pyridinyl]carbamoyl}amino)propanoic acid | C13H16F3N3O4

2-Methyl-3-(methyl{[2-(2,2,2-trifluoroethoxy)-4-pyridinyl]carbamoyl}amino)propanoic acid

  • Molecular FormulaC13H16F3N3O4
  • Average mass335.279 Da
  • Monoisotopic mass335.109283 Da
  • ChemSpider ID57983526

More details:

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

2-Methyl-3-(methyl{[2-(2,2,2-trifluorethoxy)-4-pyridinyl]carbamoyl}amino)propansäure [German] [ACD/IUPAC Name]
2-Methyl-3-(methyl{[2-(2,2,2-trifluoroethoxy)-4-pyridinyl]carbamoyl}amino)propanoic acid [ACD/IUPAC Name]
Acide 2-méthyl-3-(méthyl{[2-(2,2,2-trifluoroéthoxy)-4-pyridinyl]carbamoyl}amino)propanoïque [French] [ACD/IUPAC Name]
Propanoic acid, 2-methyl-3-[methyl[[[2-(2,2,2-trifluoroethoxy)-4-pyridinyl]amino]carbonyl]amino]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 494.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 80.2±3.0 kJ/mol
Flash Point: 252.6±28.7 °C
Index of Refraction: 1.528
Molar Refractivity: 74.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.68
ACD/LogD (pH 5.5): 0.29
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.99
ACD/LogD (pH 7.4): -1.44
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 92 Å2
Polarizability: 29.4±0.5 10-24cm3
Surface Tension: 46.5±3.0 dyne/cm
Molar Volume: 240.9±3.0 cm3

Click to predict properties on the Chemicalize site


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