ChemSpider 2D Image | 9-[(3xi)-2-Deoxy-5-O-phosphono-beta-D-glycero-pentofuranosyl]-9H-purine-2,6-diamine | C10H15N6O6P

9-[(3ξ)-2-Deoxy-5-O-phosphono-β-D-glycero-pentofuranosyl]-9H-purine-2,6-diamine

  • Molecular FormulaC10H15N6O6P
  • Average mass346.237 Da
  • Monoisotopic mass346.079071 Da
  • ChemSpider ID57491448

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

9-[(3ξ)-2-Deoxy-5-O-phosphono-β-D-glycero-pentofuranosyl]-9H-purine-2,6-diamine [ACD/IUPAC Name]
9-[(3ξ)-2-Desoxy-5-O-phosphono-β-D-glycero-pentofuranosyl]-9H-purin-2,6-diamin [German] [ACD/IUPAC Name]
9-[(3ξ)-2-Désoxy-5-O-phosphono-β-D-glycéro-pentofuranosyl]-9H-purine-2,6-diamine [French] [ACD/IUPAC Name]
9H-Purine-2,6-diamine, 9-[(3ξ)-2-deoxy-5-O-phosphono-β-D-glycero-pentofuranosyl]- [ACD/Index Name]
4546-60-5 [RN]

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

Density: 2.3±0.1 g/cm3
Boiling Point: 864.9±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 131.7±3.0 kJ/mol
Flash Point: 476.9±37.1 °C
Index of Refraction: 1.930
Molar Refractivity: 71.0±0.5 cm3
#H bond acceptors: 12
#H bond donors: 7
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: -1.29
ACD/LogD (pH 5.5): -5.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.35
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 202 Å2
Polarizability: 28.1±0.5 10-24cm3
Surface Tension: 144.5±7.0 dyne/cm
Molar Volume: 149.1±7.0 cm3

Click to predict properties on the Chemicalize site


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