ChemSpider 2D Image | 4-Chloro-2-{[4-(trifluoromethyl)phenyl]carbamoyl}phenyl 2-pyrazinecarboxylate | C19H11ClF3N3O3

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

  • Molecular FormulaC19H11ClF3N3O3
  • Average mass421.757 Da
  • Monoisotopic mass421.044098 Da
  • ChemSpider ID34550347

More details:

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

2-Pyrazinecarboxylate de 4-chloro-2-{[4-(trifluorométhyl)phényl]carbamoyl}phényle [French] [ACD/IUPAC Name]
2-Pyrazinecarboxylic acid, 4-chloro-2-[[[4-(trifluoromethyl)phenyl]amino]carbonyl]phenyl ester [ACD/Index Name]
4-Chlor-2-{[4-(trifluormethyl)phenyl]carbamoyl}phenyl-2-pyrazincarboxylat [German] [ACD/IUPAC Name]
4-Chloro-2-{[4-(trifluoromethyl)phenyl]carbamoyl}phenyl 2-pyrazinecarboxylate [ACD/IUPAC 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: 507.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.7±3.0 kJ/mol
Flash Point: 260.4±30.1 °C
Index of Refraction: 1.612
Molar Refractivity: 98.5±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.26
ACD/LogD (pH 5.5): 4.24
ACD/BCF (pH 5.5): 974.35
ACD/KOC (pH 5.5): 4796.49
ACD/LogD (pH 7.4): 4.24
ACD/BCF (pH 7.4): 974.33
ACD/KOC (pH 7.4): 4796.38
Polar Surface Area: 81 Å2
Polarizability: 39.1±0.5 10-24cm3
Surface Tension: 53.1±3.0 dyne/cm
Molar Volume: 283.6±3.0 cm3

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