ChemSpider 2D Image | Ethyl 4-fluoro-1-methyl-1H-pyrazole-3-carboxylate | C7H9FN2O2

Ethyl 4-fluoro-1-methyl-1H-pyrazole-3-carboxylate

  • Molecular FormulaC7H9FN2O2
  • Average mass172.157 Da
  • Monoisotopic mass172.064804 Da
  • ChemSpider ID72390177

More details:

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

1H-Pyrazole-3-carboxylic acid, 4-fluoro-1-methyl-, ethyl ester [ACD/Index Name]
4-Fluoro-1-méthyl-1H-pyrazole-3-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4-fluoro-1-methyl-1H-pyrazole-3-carboxylate [ACD/IUPAC Name]
Ethyl-4-fluor-1-methyl-1H-pyrazol-3-carboxylat [German] [ACD/IUPAC Name]
1914176-53-6 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 253.8±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.1±3.0 kJ/mol
Flash Point: 107.3±23.2 °C
Index of Refraction: 1.510
Molar Refractivity: 41.0±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.58
ACD/LogD (pH 5.5): 0.92
ACD/BCF (pH 5.5): 2.96
ACD/KOC (pH 5.5): 75.67
ACD/LogD (pH 7.4): 0.92
ACD/BCF (pH 7.4): 2.96
ACD/KOC (pH 7.4): 75.67
Polar Surface Area: 44 Å2
Polarizability: 16.3±0.5 10-24cm3
Surface Tension: 35.1±7.0 dyne/cm
Molar Volume: 137.1±7.0 cm3

Click to predict properties on the Chemicalize site


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