ChemSpider 2D Image | Ethyl 3-(4-chlorophenyl)-1-(2-oxo-2-phenylethyl)-1H-pyrazole-5-carboxylate | C20H17ClN2O3

Ethyl 3-(4-chlorophenyl)-1-(2-oxo-2-phenylethyl)-1H-pyrazole-5-carboxylate

  • Molecular FormulaC20H17ClN2O3
  • Average mass368.814 Da
  • Monoisotopic mass368.092773 Da
  • ChemSpider ID30656889

More details:

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

1H-Pyrazole-5-carboxylic acid, 3-(4-chlorophenyl)-1-(2-oxo-2-phenylethyl)-, ethyl ester [ACD/Index Name]
3-(4-Chlorophényl)-1-(2-oxo-2-phényléthyl)-1H-pyrazole-5-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 3-(4-chlorophenyl)-1-(2-oxo-2-phenylethyl)-1H-pyrazole-5-carboxylate [ACD/IUPAC Name]
Ethyl-3-(4-chlorphenyl)-1-(2-oxo-2-phenylethyl)-1H-pyrazol-5-carboxylat [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 549.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.9±3.0 kJ/mol
Flash Point: 286.0±30.1 °C
Index of Refraction: 1.608
Molar Refractivity: 101.6±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.43
ACD/LogD (pH 5.5): 4.45
ACD/BCF (pH 5.5): 1432.36
ACD/KOC (pH 5.5): 6319.76
ACD/LogD (pH 7.4): 4.45
ACD/BCF (pH 7.4): 1432.36
ACD/KOC (pH 7.4): 6319.77
Polar Surface Area: 61 Å2
Polarizability: 40.3±0.5 10-24cm3
Surface Tension: 46.6±7.0 dyne/cm
Molar Volume: 293.9±7.0 cm3

Click to predict properties on the Chemicalize site


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