ChemSpider 2D Image | 3-Amino-1-(2-fluoroethyl)-1H-pyrazole-4-carboxylic acid | C6H8FN3O2

3-Amino-1-(2-fluoroethyl)-1H-pyrazole-4-carboxylic acid

  • Molecular FormulaC6H8FN3O2
  • Average mass173.145 Da
  • Monoisotopic mass173.060059 Da
  • ChemSpider ID68901338

More details:

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

1H-Pyrazole-4-carboxylic acid, 3-amino-1-(2-fluoroethyl)- [ACD/Index Name]
3-Amino-1-(2-fluorethyl)-1H-pyrazol-4-carbonsäure [German] [ACD/IUPAC Name]
3-Amino-1-(2-fluoroethyl)-1H-pyrazole-4-carboxylic acid [ACD/IUPAC Name]
Acide 3-amino-1-(2-fluoroéthyl)-1H-pyrazole-4-carboxylique [French] [ACD/IUPAC Name]
2171314-78-4 [RN]
3-amino-1-(2-fluoroethyl)pyrazole-4-carboxylic acid

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

Density: 1.6±0.1 g/cm3
Boiling Point: 394.6±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.0±3.0 kJ/mol
Flash Point: 192.5±26.5 °C
Index of Refraction: 1.608
Molar Refractivity: 38.1±0.5 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.59
ACD/LogD (pH 5.5): -0.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.71
ACD/LogD (pH 7.4): -1.96
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 81 Å2
Polarizability: 15.1±0.5 10-24cm3
Surface Tension: 57.4±7.0 dyne/cm
Molar Volume: 110.3±7.0 cm3

Click to predict properties on the Chemicalize site


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