ChemSpider 2D Image | 1-(3-O-Phosphono-alpha-L-arabinofuranosyl)-2,4(1H,3H)-pyrimidinedione | C9H13N2O9P

1-(3-O-Phosphono-α-L-arabinofuranosyl)-2,4(1H,3H)-pyrimidinedione

  • Molecular FormulaC9H13N2O9P
  • Average mass324.181 Da
  • Monoisotopic mass324.035858 Da
  • ChemSpider ID26329797

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

1-(3-O-Phosphono-α-L-arabinofuranosyl)-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]
1-(3-O-Phosphono-α-L-arabinofuranosyl)-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
1-(3-O-Phosphono-α-L-arabinofuranosyl)-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]
2,4(1H,3H)-Pyrimidinedione, 1-(3-O-phosphono-α-L-arabinofuranosyl)- [ACD/Index Name]
{[(2S,3R,4R,5R)-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy}phosphonic acid
1-(3-O-PHOSPHONO-β-L-ARABINOFURANOSYL)PYRIMIDINE-2,4(1H,3H)-DIONE

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

Density: 1.9±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.659
Molar Refractivity: 63.6±0.4 cm3
#H bond acceptors: 11
#H bond donors: 5
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: -2.79
ACD/LogD (pH 5.5): -6.85
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.79
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 176 Å2
Polarizability: 25.2±0.5 10-24cm3
Surface Tension: 108.1±5.0 dyne/cm
Molar Volume: 172.4±5.0 cm3

Click to predict properties on the Chemicalize site


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