ChemSpider 2D Image | 4-[(Phosphonooxy)methyl]-4,5,6,7-tetrahydro-2H-pyrazolo[4,3-c]pyridine-4-carboxylic acid | C8H12N3O6P

4-[(Phosphonooxy)methyl]-4,5,6,7-tetrahydro-2H-pyrazolo[4,3-c]pyridine-4-carboxylic acid

  • Molecular FormulaC8H12N3O6P
  • Average mass277.171 Da
  • Monoisotopic mass277.046356 Da
  • ChemSpider ID91282389

More details:

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

2H-Pyrazolo[4,3-c]pyridine-4-carboxylic acid, 4,5,6,7-tetrahydro-4-[(phosphonooxy)methyl]- [ACD/Index Name]
4-[(Phosphonooxy)methyl]-4,5,6,7-tetrahydro-2H-pyrazolo[4,3-c]pyridin-4-carbonsäure [German] [ACD/IUPAC Name]
4-[(Phosphonooxy)methyl]-4,5,6,7-tetrahydro-2H-pyrazolo[4,3-c]pyridine-4-carboxylic acid [ACD/IUPAC Name]
Acide 4-[(phosphonooxy)méthyl]-4,5,6,7-tétrahydro-2H-pyrazolo[4,3-c]pyridine-4-carboxylique [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 681.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 105.0±3.0 kJ/mol
Flash Point: 365.7±34.3 °C
Index of Refraction: 1.621
Molar Refractivity: 56.7±0.3 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: -2.60
ACD/LogD (pH 5.5): -5.98
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.77
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 155 Å2
Polarizability: 22.5±0.5 10-24cm3
Surface Tension: 94.3±3.0 dyne/cm
Molar Volume: 161.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement