ChemSpider 2D Image | 4-Methyl-4-({[2-(2,2,2-trifluoroethoxy)-4-pyrimidinyl]carbamoyl}amino)pentanoic acid | C13H17F3N4O4

4-Methyl-4-({[2-(2,2,2-trifluoroethoxy)-4-pyrimidinyl]carbamoyl}amino)pentanoic acid

  • Molecular FormulaC13H17F3N4O4
  • Average mass350.294 Da
  • Monoisotopic mass350.120178 Da
  • ChemSpider ID57991641

More details:

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

4-Methyl-4-({[2-(2,2,2-trifluorethoxy)-4-pyrimidinyl]carbamoyl}amino)pentansäure [German] [ACD/IUPAC Name]
4-Methyl-4-({[2-(2,2,2-trifluoroethoxy)-4-pyrimidinyl]carbamoyl}amino)pentanoic acid [ACD/IUPAC Name]
Acide 4-méthyl-4-({[2-(2,2,2-trifluoroéthoxy)-4-pyrimidinyl]carbamoyl}amino)pentanoïque [French] [ACD/IUPAC Name]
Pentanoic acid, 4-methyl-4-[[[[2-(2,2,2-trifluoroethoxy)-4-pyrimidinyl]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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.522
Molar Refractivity: 76.8±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.63
ACD/LogD (pH 5.5): 1.15
ACD/BCF (pH 5.5): 2.36
ACD/KOC (pH 5.5): 30.76
ACD/LogD (pH 7.4): -0.65
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 113 Å2
Polarizability: 30.4±0.5 10-24cm3
Surface Tension: 48.0±3.0 dyne/cm
Molar Volume: 251.9±3.0 cm3

Click to predict properties on the Chemicalize site


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