ChemSpider 2D Image | Ethyl 5-amino-1-(2,4,6-trichlorophenyl)-1H-pyrazole-3-carboxylate | C12H10Cl3N3O2

Ethyl 5-amino-1-(2,4,6-trichlorophenyl)-1H-pyrazole-3-carboxylate

  • Molecular FormulaC12H10Cl3N3O2
  • Average mass334.586 Da
  • Monoisotopic mass332.983856 Da
  • ChemSpider ID32126341

More details:

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

1H-Pyrazole-3-carboxylic acid, 5-amino-1-(2,4,6-trichlorophenyl)-, ethyl ester [ACD/Index Name]
5-Amino-1-(2,4,6-trichlorophényl)-1H-pyrazole-3-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 5-amino-1-(2,4,6-trichlorophenyl)-1H-pyrazole-3-carboxylate [ACD/IUPAC Name]
Ethyl-5-amino-1-(2,4,6-trichlorphenyl)-1H-pyrazol-3-carboxylat [German] [ACD/IUPAC 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: 489.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.6±3.0 kJ/mol
Flash Point: 250.0±28.7 °C
Index of Refraction: 1.652
Molar Refractivity: 77.5±0.5 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.44
ACD/LogD (pH 5.5): 3.86
ACD/BCF (pH 5.5): 500.91
ACD/KOC (pH 5.5): 2979.14
ACD/LogD (pH 7.4): 3.86
ACD/BCF (pH 7.4): 500.91
ACD/KOC (pH 7.4): 2979.15
Polar Surface Area: 70 Å2
Polarizability: 30.7±0.5 10-24cm3
Surface Tension: 53.4±7.0 dyne/cm
Molar Volume: 211.9±7.0 cm3

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