ChemSpider 2D Image | 3-Amino-1-(2,2-difluoroethyl)-N-propyl-1H-pyrazole-4-carboxamide | C9H14F2N4O

3-Amino-1-(2,2-difluoroethyl)-N-propyl-1H-pyrazole-4-carboxamide

  • Molecular FormulaC9H14F2N4O
  • Average mass232.230 Da
  • Monoisotopic mass232.113571 Da
  • ChemSpider ID68901417

More details:

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

1H-Pyrazole-4-carboxamide, 3-amino-1-(2,2-difluoroethyl)-N-propyl- [ACD/Index Name]
3-Amino-1-(2,2-difluorethyl)-N-propyl-1H-pyrazol-4-carboxamid [German] [ACD/IUPAC Name]
3-Amino-1-(2,2-difluoroethyl)-N-propyl-1H-pyrazole-4-carboxamide [ACD/IUPAC Name]
3-Amino-1-(2,2-difluoroéthyl)-N-propyl-1H-pyrazole-4-carboxamide [French] [ACD/IUPAC Name]
2171317-99-8 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 419.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.3±3.0 kJ/mol
Flash Point: 207.5±28.7 °C
Index of Refraction: 1.553
Molar Refractivity: 53.9±0.5 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.25
ACD/LogD (pH 5.5): 1.00
ACD/BCF (pH 5.5): 3.41
ACD/KOC (pH 5.5): 83.75
ACD/LogD (pH 7.4): 1.00
ACD/BCF (pH 7.4): 3.41
ACD/KOC (pH 7.4): 83.76
Polar Surface Area: 73 Å2
Polarizability: 21.4±0.5 10-24cm3
Surface Tension: 41.2±7.0 dyne/cm
Molar Volume: 168.2±7.0 cm3

Click to predict properties on the Chemicalize site


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