ChemSpider 2D Image | 4-Amino-3-hydroxy-6-methyltetrahydro-2H-pyran-2-yl [3-hydroxy-5-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)tetrahydro-2-furanyl]methyl dihydrogen diphosphate | C16H27N3O13P2

4-Amino-3-hydroxy-6-methyltetrahydro-2H-pyran-2-yl [3-hydroxy-5-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)tetrahydro-2-furanyl]methyl dihydrogen diphosphate

  • Molecular FormulaC16H27N3O13P2
  • Average mass531.345 Da
  • Monoisotopic mass531.101929 Da
  • ChemSpider ID4295219

More details:

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

4-Amino-3-hydroxy-6-methyltetrahydro-2H-pyran-2-yl [3-hydroxy-5-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)tetrahydro-2-furanyl]methyl dihydrogen diphosphate [ACD/IUPAC Name]
4-Amino-3-hydroxy-6-methyltetrahydro-2H-pyran-2-yl-[3-hydroxy-5-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)tetrahydro-2-furanyl]methyldihydrogendiphosphat [German] [ACD/IUPAC Name]
Dihydrogénodiphosphate de 4-amino-3-hydroxy-6-méthyltétrahydro-2H-pyran-2-yle et de [3-hydroxy-5-(5-méthyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)tétrahydro-2-furanyl]méthyle [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.609
Molar Refractivity: 109.3±0.4 cm3
#H bond acceptors: 16
#H bond donors: 7
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: -4.19
ACD/LogD (pH 5.5): -8.23
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.27
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 256 Å2
Polarizability: 43.3±0.5 10-24cm3
Surface Tension: 85.5±5.0 dyne/cm
Molar Volume: 315.5±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement