ChemSpider 2D Image | (5R)-5-(7-Amino-2H-pyrazolo[4,3-d]pyrimidin-3-yl)-2,5-anhydro-1-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)-D-ribitol | C10H16N5O13P3

(5R)-5-(7-Amino-2H-pyrazolo[4,3-d]pyrimidin-3-yl)-2,5-anhydro-1-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)-D-ribitol

  • Molecular FormulaC10H16N5O13P3
  • Average mass507.181 Da
  • Monoisotopic mass506.995758 Da
  • ChemSpider ID8499417

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(5R)-5-(7-Amino-2H-pyrazolo[4,3-d]pyrimidin-3-yl)-2,5-anhydro-1-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)-D-ribitol [ACD/IUPAC Name]
(5R)-5-(7-Amino-2H-pyrazolo[4,3-d]pyrimidin-3-yl)-2,5-anhydro-1-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)-D-ribitol [German] [ACD/IUPAC Name]
(5R)-5-(7-Amino-2H-pyrazolo[4,3-d]pyrimidin-3-yl)-2,5-anhydro-1-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)-D-ribitol [French] [ACD/IUPAC Name]
D-Ribitol, 5-C-(7-amino-2H-pyrazolo[4,3-d]pyrimidin-3-yl)-2,5-anhydro-1-O-[hydroxy[[hydroxy(phosphonooxy)phosphinyl]oxy]phosphinyl]-, (5R)- [ACD/Index 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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.744
Molar Refractivity: 95.2±0.3 cm3
#H bond acceptors: 18
#H bond donors: 9
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: -5.81
ACD/LogD (pH 5.5): -11.56
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -12.50
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 319 Å2
Polarizability: 37.7±0.5 10-24cm3
Surface Tension: 155.7±3.0 dyne/cm
Molar Volume: 234.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement