ChemSpider 2D Image | 5-Amino-1-(5-O-phosphono-beta-D-ribofuranosyl)-1H-pyrazole-4-carboxylic acid | C9H14N3O9P

5-Amino-1-(5-O-phosphono-β-D-ribofuranosyl)-1H-pyrazole-4-carboxylic acid

  • Molecular FormulaC9H14N3O9P
  • Average mass339.196 Da
  • Monoisotopic mass339.046753 Da
  • ChemSpider ID25034801

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

1H-Pyrazole-4-carboxylic acid, 5-amino-1-(5-O-phosphono-β-D-ribofuranosyl)- [ACD/Index Name]
5-Amino-1-(5-O-phosphono-β-D-ribofuranosyl)-1H-pyrazol-4-carbonsäure [German] [ACD/IUPAC Name]
5-Amino-1-(5-O-phosphono-β-D-ribofuranosyl)-1H-pyrazole-4-carboxylic acid [ACD/IUPAC Name]
Acide 5-amino-1-(5-O-phosphono-β-D-ribofuranosyl)-1H-pyrazole-4-carboxylique [French] [ACD/IUPAC Name]

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

Density: 2.3±0.1 g/cm3
Boiling Point: 792.6±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 120.9±3.0 kJ/mol
Flash Point: 433.1±35.7 °C
Index of Refraction: 1.809
Molar Refractivity: 63.4±0.5 cm3
#H bond acceptors: 12
#H bond donors: 7
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: -0.58
ACD/LogD (pH 5.5): -6.03
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.91
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 207 Å2
Polarizability: 25.2±0.5 10-24cm3
Surface Tension: 136.9±7.0 dyne/cm
Molar Volume: 147.2±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement