ChemSpider 2D Image | (2r,3s,5s,6r)-5-Amino-3-Hydroxy-6-Methyl-Oxan-2-Yl | C16H26N6O13P2

(2r,3s,5s,6r)-5-Amino-3-Hydroxy-6-Methyl-Oxan-2-Yl

  • Molecular FormulaC16H26N6O13P2
  • Average mass572.358 Da
  • Monoisotopic mass572.103333 Da
  • ChemSpider ID25061211

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(2r,3s,5s,6r)-5-Amino-3-Hydroxy-6-Methyl-Oxan-2-Yl
(2R,3S,5S,6R)-5-Amino-3-hydroxy-6-methyltetrahydro-2H-pyran-2-yl [(2R,3S,4R,5R)-5-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-3,4-dihydroxytetrahydro-2-furanyl]methyl dihydrogen diphosphate (non-preferr ed name) [ACD/IUPAC Name]
(2R,3S,5S,6R)-5-Amino-3-hydroxy-6-methyltetrahydro-2H-pyran-2-yl-[(2R,3S,4R,5R)-5-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-3,4-dihydroxytetrahydro-2-furanyl]methyldihydrogendiphosphat (non-preferred name) [German] [ACD/IUPAC Name]
Dihydrogénodiphosphate de (2R,3S,5S,6R)-5-amino-3-hydroxy-6-méthyltétrahydro-2H-pyran-2-yle et de [(2R,3S,4R,5R)-5-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-3,4-dihydroxytétrahydro-2-furanyl]méthyle ( non-preferred name) [French] [ACD/IUPAC Name]
GPD

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 2.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.860
Molar Refractivity: 110.3±0.5 cm3
#H bond acceptors: 19
#H bond donors: 10
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: -3.37
ACD/LogD (pH 5.5): -7.55
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.56
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 312 Å2
Polarizability: 43.7±0.5 10-24cm3
Surface Tension: 137.9±7.0 dyne/cm
Molar Volume: 244.8±7.0 cm3

Click to predict properties on the Chemicalize site


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