ChemSpider 2D Image | 2-Amino-4-oxo-7-(D-ribofuranosyl)-4,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-5-carboxylic acid | C12H14N4O7

2-Amino-4-oxo-7-(D-ribofuranosyl)-4,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-5-carboxylic acid

  • Molecular FormulaC12H14N4O7
  • Average mass326.262 Da
  • Monoisotopic mass326.086243 Da
  • ChemSpider ID24672568

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

2-Amino-4-oxo-7-(D-ribofuranosyl)-4,7-dihydro-1H-pyrrolo[2,3-d]pyrimidin-5-carbonsäure [German] [ACD/IUPAC Name]
2-Amino-4-oxo-7-(D-ribofuranosyl)-4,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-5-carboxylic acid [ACD/IUPAC Name]
7H-Pyrrolo[2,3-d]pyrimidine-5-carboxylic acid, 2-amino-4-hydroxy-7-D-ribofuranosyl- [ACD/Index Name]
Acide 2-amino-4-oxo-7-(D-ribofuranosyl)-4,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-5-carboxylique [French] [ACD/IUPAC Name]

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

Density: 2.2±0.1 g/cm3
Boiling Point: 893.3±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 136.0±3.0 kJ/mol
Flash Point: 494.1±37.1 °C
Index of Refraction: 1.901
Molar Refractivity: 68.7±0.5 cm3
#H bond acceptors: 11
#H bond donors: 7
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: -1.33
ACD/LogD (pH 5.5): -4.66
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.67
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 184 Å2
Polarizability: 27.2±0.5 10-24cm3
Surface Tension: 119.2±7.0 dyne/cm
Molar Volume: 147.5±7.0 cm3

Click to predict properties on the Chemicalize site


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