ChemSpider 2D Image | 1-Allyl-3-amino-1H-pyrazole-4-carboxylic acid | C7H9N3O2

1-Allyl-3-amino-1H-pyrazole-4-carboxylic acid

  • Molecular FormulaC7H9N3O2
  • Average mass167.165 Da
  • Monoisotopic mass167.069473 Da
  • ChemSpider ID24741075

More details:

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

1-Allyl-3-amino-1H-pyrazol-4-carbonsäure [German] [ACD/IUPAC Name]
1-Allyl-3-amino-1H-pyrazole-4-carboxylic acid [ACD/IUPAC Name]
1H-Pyrazole-4-carboxylic acid, 3-amino-1-(2-propen-1-yl)- [ACD/Index Name]
Acide 1-allyl-3-amino-1H-pyrazole-4-carboxylique [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: 372.8±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.4±3.0 kJ/mol
Flash Point: 179.3±26.5 °C
Index of Refraction: 1.613
Molar Refractivity: 42.7±0.5 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.08
ACD/LogD (pH 5.5): 0.27
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 12.94
ACD/LogD (pH 7.4): -1.42
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 81 Å2
Polarizability: 16.9±0.5 10-24cm3
Surface Tension: 55.4±7.0 dyne/cm
Molar Volume: 122.7±7.0 cm3

Click to predict properties on the Chemicalize site


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