ChemSpider 2D Image | adenosine-2'-5'-diphosphate | C10H15N5O10P2

adenosine-2'-5'-diphosphate

  • Molecular FormulaC10H15N5O10P2
  • Average mass427.201 Da
  • Monoisotopic mass427.029419 Da
  • ChemSpider ID26329644
  • defined stereocentres - 4 of 4 defined stereocentres


More details:






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

9-(2,5-Di-O-phosphono-α-L-arabinofuranosyl)-9H-purin-6-amin [German] [ACD/IUPAC Name]
9-(2,5-Di-O-phosphono-α-L-arabinofuranosyl)-9H-purin-6-amine [ACD/IUPAC Name]
9-(2,5-Di-O-phosphono-α-L-arabinofuranosyl)-9H-purin-6-amine [French] [ACD/IUPAC Name]
9H-Purin-6-amine, 9-(2,5-di-O-phosphono-α-L-arabinofuranosyl)- [ACD/Index Name]
adenosine-2'-5'-diphosphate
{[(2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3-hydroxy-4-(phosphonooxy)oxolan-2-yl]methoxy}phosphonic acid

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

Density: 2.5±0.1 g/cm3
Boiling Point: 924.3±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 140.8±3.0 kJ/mol
Flash Point: 512.8±37.1 °C
Index of Refraction: 1.905
Molar Refractivity: 79.9±0.5 cm3
#H bond acceptors: 15
#H bond donors: 7
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: -2.23
ACD/LogD (pH 5.5): -8.22
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -9.77
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 252 Å2
Polarizability: 31.7±0.5 10-24cm3
Surface Tension: 170.8±7.0 dyne/cm
Molar Volume: 171.1±7.0 cm3

Click to predict properties on the Chemicalize site






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