ChemSpider 2D Image | [(2R,3S,4R,5R)-5-(2-Amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-3,4,5-trihydroxytetrahydro-2-furanyl]methyl dihydrogen phosphate | C10H14N5O9P

[(2R,3S,4R,5R)-5-(2-Amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-3,4,5-trihydroxytetrahydro-2-furanyl]methyl dihydrogen phosphate

  • Molecular FormulaC10H14N5O9P
  • Average mass379.220 Da
  • Monoisotopic mass379.052917 Da
  • ChemSpider ID29316367

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

[(2R,3S,4R,5R)-5-(2-Amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-3,4,5-trihydroxytetrahydro-2-furanyl]methyl dihydrogen phosphate [ACD/IUPAC Name]
[(2R,3S,4R,5R)-5-(2-Amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-3,4,5-trihydroxytetrahydro-2-furanyl]methyldihydrogenphosphat [German] [ACD/IUPAC Name]
Dihydrogénophosphate de [(2R,3S,4R,5R)-5-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-3,4,5-trihydroxytétrahydro-2-furanyl]méthyle [French] [ACD/IUPAC Name]

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

Density: 2.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.949
Molar Refractivity: 72.1±0.5 cm3
#H bond acceptors: 14
#H bond donors: 8
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: 0.58
ACD/LogD (pH 5.5): -4.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.18
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 232 Å2
Polarizability: 28.6±0.5 10-24cm3
Surface Tension: 172.3±7.0 dyne/cm
Molar Volume: 149.5±7.0 cm3

Click to predict properties on the Chemicalize site


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