ChemSpider 2D Image | 4,4,4-Trifluoro-2-[({1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazol-4-yl}carbonyl)amino]butanoic acid | C14H10F6N4O3

4,4,4-Trifluoro-2-[({1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazol-4-yl}carbonyl)amino]butanoic acid

  • Molecular FormulaC14H10F6N4O3
  • Average mass396.245 Da
  • Monoisotopic mass396.065704 Da
  • ChemSpider ID57814422

More details:

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

4,4,4-Trifluor-2-[({1-[3-(trifluormethyl)phenyl]-1H-1,2,3-triazol-4-yl}carbonyl)amino]butansäure [German] [ACD/IUPAC Name]
4,4,4-Trifluoro-2-[({1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazol-4-yl}carbonyl)amino]butanoic acid [ACD/IUPAC Name]
Acide 4,4,4-trifluoro-2-[({1-[3-(trifluorométhyl)phényl]-1H-1,2,3-triazol-4-yl}carbonyl)amino]butanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 4,4,4-trifluoro-2-[[[1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazol-4-yl]carbonyl]amino]- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.547
Molar Refractivity: 77.9±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.57
ACD/LogD (pH 5.5): -1.42
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.95
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 97 Å2
Polarizability: 30.9±0.5 10-24cm3
Surface Tension: 42.2±7.0 dyne/cm
Molar Volume: 245.8±7.0 cm3

Click to predict properties on the Chemicalize site


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