ChemSpider 2D Image | 1-(2-{[(2,2,2-Trifluoroethoxy)carbonyl]amino}ethyl)-1H-1,2,3-triazole-4-carboxylic acid | C8H9F3N4O4

1-(2-{[(2,2,2-Trifluoroethoxy)carbonyl]amino}ethyl)-1H-1,2,3-triazole-4-carboxylic acid

  • Molecular FormulaC8H9F3N4O4
  • Average mass282.177 Da
  • Monoisotopic mass282.057587 Da
  • ChemSpider ID49245568

More details:

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

1-(2-{[(2,2,2-Trifluorethoxy)carbonyl]amino}ethyl)-1H-1,2,3-triazol-4-carbonsäure [German] [ACD/IUPAC Name]
1-(2-{[(2,2,2-Trifluoroethoxy)carbonyl]amino}ethyl)-1H-1,2,3-triazole-4-carboxylic acid [ACD/IUPAC Name]
1H-1,2,3-Triazole-4-carboxylic acid, 1-[2-[[(2,2,2-trifluoroethoxy)carbonyl]amino]ethyl]- [ACD/Index Name]
Acide 1-(2-{[(2,2,2-trifluoroéthoxy)carbonyl]amino}éthyl)-1H-1,2,3-triazole-4-carboxylique [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.548
Molar Refractivity: 54.1±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 0.57
ACD/LogD (pH 5.5): -1.37
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.45
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 106 Å2
Polarizability: 21.4±0.5 10-24cm3
Surface Tension: 50.2±7.0 dyne/cm
Molar Volume: 170.3±7.0 cm3

Click to predict properties on the Chemicalize site


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