ChemSpider 2D Image | 2-(2-Oxo-1-pyrrolidinyl)ethyl 3-(2,4-difluorophenyl)-1-methyl-1H-pyrazole-4-carboxylate | C17H17F2N3O3

2-(2-Oxo-1-pyrrolidinyl)ethyl 3-(2,4-difluorophenyl)-1-methyl-1H-pyrazole-4-carboxylate

  • Molecular FormulaC17H17F2N3O3
  • Average mass349.332 Da
  • Monoisotopic mass349.123810 Da
  • ChemSpider ID30479519

More details:

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

1H-Pyrazole-4-carboxylic acid, 3-(2,4-difluorophenyl)-1-methyl-, 2-(2-oxo-1-pyrrolidinyl)ethyl ester [ACD/Index Name]
2-(2-Oxo-1-pyrrolidinyl)ethyl 3-(2,4-difluorophenyl)-1-methyl-1H-pyrazole-4-carboxylate [ACD/IUPAC Name]
2-(2-Oxo-1-pyrrolidinyl)ethyl-3-(2,4-difluorphenyl)-1-methyl-1H-pyrazol-4-carboxylat [German] [ACD/IUPAC Name]
3-(2,4-Difluorophényl)-1-méthyl-1H-pyrazole-4-carboxylate de 2-(2-oxo-1-pyrrolidinyl)éthyle [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 534.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.0±3.0 kJ/mol
Flash Point: 276.8±30.1 °C
Index of Refraction: 1.603
Molar Refractivity: 86.9±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.34
ACD/LogD (pH 5.5): 2.33
ACD/BCF (pH 5.5): 34.77
ACD/KOC (pH 5.5): 441.39
ACD/LogD (pH 7.4): 2.33
ACD/BCF (pH 7.4): 34.77
ACD/KOC (pH 7.4): 441.39
Polar Surface Area: 64 Å2
Polarizability: 34.4±0.5 10-24cm3
Surface Tension: 45.7±7.0 dyne/cm
Molar Volume: 253.0±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement