ChemSpider 2D Image | [(2R,3S,5R)-5-(2-Amino-6-oxo-3,6-dihydro-9H-purin-9-yl)-3-hydroxytetrahydro-2-furanyl]methyl [(2R,3S,5R)-5-(6-amino-9H-purin-9-yl)-3-hydroxytetrahydro-2-furanyl]methyl hydrogen phosphate (non-preferre d name) | C20H25N10O9P

[(2R,3S,5R)-5-(2-Amino-6-oxo-3,6-dihydro-9H-purin-9-yl)-3-hydroxytetrahydro-2-furanyl]methyl [(2R,3S,5R)-5-(6-amino-9H-purin-9-yl)-3-hydroxytetrahydro-2-furanyl]methyl hydrogen phosphate (non-preferre d name)

  • Molecular FormulaC20H25N10O9P
  • Average mass580.448 Da
  • Monoisotopic mass580.154358 Da
  • ChemSpider ID167816

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

[(2R,3S,5R)-5-(2-Amino-6-oxo-3,6-dihydro-9H-purin-9-yl)-3-hydroxytetrahydro-2-furanyl]methyl [(2R,3S,5R)-5-(6-amino-9H-purin-9-yl)-3-hydroxytetrahydro-2-furanyl]methyl hydrogen phosphate (non-preferre d name) [ACD/IUPAC Name]
[(2R,3S,5R)-5-(2-Amino-6-oxo-3,6-dihydro-9H-purin-9-yl)-3-hydroxytetrahydro-2-furanyl]methyl-[(2R,3S,5R)-5-(6-amino-9H-purin-9-yl)-3-hydroxytetrahydro-2-furanyl]methylhydrogenphosphat (non-preferred n ame) [German] [ACD/IUPAC Name]
Hydrogénophosphate de [(2R,3S,5R)-5-(2-amino-6-oxo-3,6-dihydro-9H-purin-9-yl)-3-hydroxytétrahydro-2-furanyl]méthyle et de [(2R,3S,5R)-5-(6-amino-9H-purin-9-yl)-3-hydroxytétrahydro-2-furanyl]méthyle (n on-preferred name) [French] [ACD/IUPAC Name]
4282-64-8 [RN]
Deoxyguanosyl-3',5'-deoxyadenosine monophosphate
Deoxyguanylyl-(3'-5')-deoxyadenosine
dG(3'-5')dA
dGpA
Guanosine, 2'-deoxyadenylyl-(5'-3')-2'-deoxy-

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

Density: 2.2±0.1 g/cm3
Boiling Point: 1064.3±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 163.3±3.0 kJ/mol
Flash Point: 597.5±37.1 °C
Index of Refraction: 1.962
Molar Refractivity: 126.2±0.5 cm3
#H bond acceptors: 19
#H bond donors: 8
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: -2.83
ACD/LogD (pH 5.5): -6.16
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 279 Å2
Polarizability: 50.0±0.5 10-24cm3
Surface Tension: 131.1±7.0 dyne/cm
Molar Volume: 259.0±7.0 cm3

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