ChemSpider 2D Image | 9-(2-Deoxy-5-O-phosphono-beta-D-threo-pentofuranosyl)-9H-purin-6-amine | C10H14N5O6P

9-(2-Deoxy-5-O-phosphono-β-D-threo-pentofuranosyl)-9H-purin-6-amine

  • Molecular FormulaC10H14N5O6P
  • Average mass331.222 Da
  • Monoisotopic mass331.068176 Da
  • ChemSpider ID48058563

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

9-(2-Deoxy-5-O-phosphono-β-D-threo-pentofuranosyl)-9H-purin-6-amine [ACD/IUPAC Name]
9-(2-Desoxy-5-O-phosphono-β-D-threo-pentofuranosyl)-9H-purin-6-amin [German] [ACD/IUPAC Name]
9-(2-Désoxy-5-O-phosphono-β-D-thréo-pentofuranosyl)-9H-purin-6-amine [French] [ACD/IUPAC Name]
9H-Purin-6-amine, 9-(2-deoxy-5-O-phosphono-β-D-threo-pentofuranosyl)- [ACD/Index Name]
[(2R,3R,5R)-5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]methyl dihydrogen phosphate
143838-78-2 [RN]
2'-Deoxyadenosine-5'-monophosphate free acid
5'-dAMP free acid
653-63-4 [RN]

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

Density: 2.2±0.1 g/cm3
Boiling Point: 753.5±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 115.2±3.0 kJ/mol
Flash Point: 409.5±35.7 °C
Index of Refraction: 1.867
Molar Refractivity: 69.1±0.5 cm3
#H bond acceptors: 11
#H bond donors: 5
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: -1.23
ACD/LogD (pH 5.5): -5.33
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.34
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 176 Å2
Polarizability: 27.4±0.5 10-24cm3
Surface Tension: 125.4±7.0 dyne/cm
Molar Volume: 152.4±7.0 cm3

Click to predict properties on the Chemicalize site


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