ChemSpider 2D Image | 1,3-Dichloro-1H-pyrazole-4-carboxylic acid | C4H2Cl2N2O2

1,3-Dichloro-1H-pyrazole-4-carboxylic acid

  • Molecular FormulaC4H2Cl2N2O2
  • Average mass180.977 Da
  • Monoisotopic mass179.949326 Da
  • ChemSpider ID33286936

More details:

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

1,3-Dichlor-1H-pyrazol-4-carbonsäure [German] [ACD/IUPAC Name]
1,3-Dichloro-1H-pyrazole-4-carboxylic acid [ACD/IUPAC Name]
1H-Pyrazole-4-carboxylic acid, 1,3-dichloro- [ACD/Index Name]
Acide 1,3-dichloro-1H-pyrazole-4-carboxylique [French] [ACD/IUPAC Name]
1314980-10-3 [RN]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 378.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 66.0±3.0 kJ/mol
Flash Point: 182.4±28.7 °C
Index of Refraction: 1.673
Molar Refractivity: 36.3±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.20
ACD/LogD (pH 5.5): -1.59
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.74
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 55 Å2
Polarizability: 14.4±0.5 10-24cm3
Surface Tension: 66.5±7.0 dyne/cm
Molar Volume: 97.0±7.0 cm3

Click to predict properties on the Chemicalize site


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