ChemSpider 2D Image | 3-[Ethoxy(hydroxy)phosphoryl]-1H-pyrazole-5-carboxylic acid | C6H9N2O5P

3-[Ethoxy(hydroxy)phosphoryl]-1H-pyrazole-5-carboxylic acid

  • Molecular FormulaC6H9N2O5P
  • Average mass220.120 Da
  • Monoisotopic mass220.024902 Da
  • ChemSpider ID34251539

More details:

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

1H-Pyrazole-5-carboxylic acid, 3-(ethoxyhydroxyphosphinyl)- [ACD/Index Name]
3-[Ethoxy(hydroxy)phosphoryl]-1H-pyrazol-5-carbonsäure [German] [ACD/IUPAC Name]
3-[Ethoxy(hydroxy)phosphoryl]-1H-pyrazole-5-carboxylic acid [ACD/IUPAC Name]
Acide 3-[éthoxy(hydroxy)phosphoryl]-1H-pyrazole-5-carboxylique [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 539.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 86.0±3.0 kJ/mol
Flash Point: 280.2±32.9 °C
Index of Refraction: 1.561
Molar Refractivity: 44.0±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -1.58
ACD/LogD (pH 5.5): -5.13
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.18
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 122 Å2
Polarizability: 17.5±0.5 10-24cm3
Surface Tension: 82.5±5.0 dyne/cm
Molar Volume: 136.0±5.0 cm3

Click to predict properties on the Chemicalize site


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