ChemSpider 2D Image | 2-{[4-Chloro-2-(trifluoromethyl)phenyl]amino}-2-oxoethyl 2-pyrazinecarboxylate | C14H9ClF3N3O3

2-{[4-Chloro-2-(trifluoromethyl)phenyl]amino}-2-oxoethyl 2-pyrazinecarboxylate

  • Molecular FormulaC14H9ClF3N3O3
  • Average mass359.688 Da
  • Monoisotopic mass359.028442 Da
  • ChemSpider ID21968710

More details:

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

2-{[4-Chlor-2-(trifluormethyl)phenyl]amino}-2-oxoethyl-2-pyrazincarboxylat [German] [ACD/IUPAC Name]
2-{[4-Chloro-2-(trifluoromethyl)phenyl]amino}-2-oxoethyl 2-pyrazinecarboxylate [ACD/IUPAC Name]
2-Pyrazinecarboxylate de 2-{[4-chloro-2-(trifluorométhyl)phényl]amino}-2-oxoéthyle [French] [ACD/IUPAC Name]
2-Pyrazinecarboxylic acid, 2-[[4-chloro-2-(trifluoromethyl)phenyl]amino]-2-oxoethyl ester [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 523.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.7±3.0 kJ/mol
Flash Point: 270.4±30.1 °C
Index of Refraction: 1.572
Molar Refractivity: 77.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.73
ACD/LogD (pH 5.5): 2.21
ACD/BCF (pH 5.5): 28.35
ACD/KOC (pH 5.5): 381.38
ACD/LogD (pH 7.4): 2.21
ACD/BCF (pH 7.4): 28.33
ACD/KOC (pH 7.4): 381.14
Polar Surface Area: 81 Å2
Polarizability: 30.9±0.5 10-24cm3
Surface Tension: 51.0±3.0 dyne/cm
Molar Volume: 236.7±3.0 cm3

Click to predict properties on the Chemicalize site


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