ChemSpider 2D Image | 1-{3,5-Bis-O-[hydroxy(phosphonooxy)phosphoryl]pentofuranosyl}-2,4(1H,3H)-pyrimidinedione | C9H16N2O18P4

1-{3,5-Bis-O-[hydroxy(phosphonooxy)phosphoryl]pentofuranosyl}-2,4(1H,3H)-pyrimidinedione

  • Molecular FormulaC9H16N2O18P4
  • Average mass564.121 Da
  • Monoisotopic mass563.934875 Da
  • ChemSpider ID28565332

More details:

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

1-{3,5-Bis-O-[hydroxy(phosphonooxy)phosphoryl]pentofuranosyl}-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]
1-{3,5-Bis-O-[hydroxy(phosphonooxy)phosphoryl]pentofuranosyl}-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
1-{3,5-Bis-O-[hydroxy(phosphonooxy)phosphoryl]pentofuranosyl}-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]
2,4(1H,3H)-Pyrimidinedione, 1-[3,5-bis-O-[hydroxy(phosphonooxy)phosphinyl]pentofuranosyl]- [ACD/Index Name]
56311-37-6 [RN]

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

Density: 2.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.643
Molar Refractivity: 93.6±0.4 cm3
#H bond acceptors: 20
#H bond donors: 8
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: -7.19
ACD/LogD (pH 5.5): -14.59
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -15.59
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 345 Å2
Polarizability: 37.1±0.5 10-24cm3
Surface Tension: 134.9±5.0 dyne/cm
Molar Volume: 258.8±5.0 cm3

Click to predict properties on the Chemicalize site


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