ChemSpider 2D Image | 1-Vinyl-1H-pyrazole-4-carboxylic acid | C6H6N2O2

1-Vinyl-1H-pyrazole-4-carboxylic acid

  • Molecular FormulaC6H6N2O2
  • Average mass138.124 Da
  • Monoisotopic mass138.042923 Da
  • ChemSpider ID22753751

More details:

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

1H-Pyrazole-4-carboxylic acid, 1-ethenyl- [ACD/Index Name]
1-Vinyl-1H-pyrazol-4-carbonsäure [German] [ACD/IUPAC Name]
1-Vinyl-1H-pyrazole-4-carboxylic acid [ACD/IUPAC Name]
Acide 1-vinyl-1H-pyrazole-4-carboxylique [French] [ACD/IUPAC Name]
MFCD12198429 [MDL number]
1-ethenyl-1H-pyrazole-4-carboxylic acid
1-ethenylpyrazole-4-carboxylic acid
1-VINYL-1H-PYRAZOLE-4-CARBOXYLIC ACID 95%
1-vinyl-4-pyrazolecarboxylic
1-Vinylpyrazole-4-carboxylic acid
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 184.4±23.0 °C at 760 mmHg
Vapour Pressure: 0.5±0.4 mmHg at 25°C
Enthalpy of Vaporization: 44.5±3.0 kJ/mol
Flash Point: 65.3±22.6 °C
Index of Refraction: 1.574
Molar Refractivity: 36.2±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.64
ACD/LogD (pH 5.5): -0.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.19
ACD/LogD (pH 7.4): -1.91
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 55 Å2
Polarizability: 14.3±0.5 10-24cm3
Surface Tension: 48.2±7.0 dyne/cm
Molar Volume: 109.6±7.0 cm3

Click to predict properties on the Chemicalize site


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