ChemSpider 2D Image | Ethyl 1-benzyl-3-(4-chlorophenyl)-1H-pyrazole-5-carboxylate | C19H17ClN2O2

Ethyl 1-benzyl-3-(4-chlorophenyl)-1H-pyrazole-5-carboxylate

  • Molecular FormulaC19H17ClN2O2
  • Average mass340.803 Da
  • Monoisotopic mass340.097870 Da
  • ChemSpider ID21125093

More details:

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

1-Benzyl-3-(4-chlorophényl)-1H-pyrazole-5-carboxylate d'éthyle [French] [ACD/IUPAC Name]
1H-Pyrazole-5-carboxylic acid, 3-(4-chlorophenyl)-1-(phenylmethyl)-, ethyl ester [ACD/Index Name]
Ethyl 1-benzyl-3-(4-chlorophenyl)-1H-pyrazole-5-carboxylate [ACD/IUPAC Name]
Ethyl-1-benzyl-3-(4-chlorphenyl)-1H-pyrazol-5-carboxylat [German] [ACD/IUPAC Name]
955084-74-9 [RN]
MFCD08446006

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

Density: 1.2±0.1 g/cm3
Boiling Point: 512.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.3±3.0 kJ/mol
Flash Point: 263.6±30.1 °C
Index of Refraction: 1.601
Molar Refractivity: 96.1±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.57
ACD/LogD (pH 5.5): 4.99
ACD/BCF (pH 5.5): 3684.02
ACD/KOC (pH 5.5): 12427.02
ACD/LogD (pH 7.4): 4.99
ACD/BCF (pH 7.4): 3684.02
ACD/KOC (pH 7.4): 12427.03
Polar Surface Area: 44 Å2
Polarizability: 38.1±0.5 10-24cm3
Surface Tension: 44.2±7.0 dyne/cm
Molar Volume: 280.6±7.0 cm3

Click to predict properties on the Chemicalize site


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