ChemSpider 2D Image | 2-Amino-9-[(2xi)-3-amino-3-deoxy-beta-D-threo-pentofuranosyl]-1,9-dihydro-6H-purin-6-one | C10H14N6O4

2-Amino-9-[(2ξ)-3-amino-3-deoxy-β-D-threo-pentofuranosyl]-1,9-dihydro-6H-purin-6-one

  • Molecular FormulaC10H14N6O4
  • Average mass282.256 Da
  • Monoisotopic mass282.107666 Da
  • ChemSpider ID71116569

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

2-Amino-9-[(2ξ)-3-amino-3-deoxy-β-D-threo-pentofuranosyl]-1,9-dihydro-6H-purin-6-one [ACD/IUPAC Name]
2-Amino-9-[(2ξ)-3-amino-3-desoxy-β-D-threo-pentofuranosyl]-1,9-dihydro-6H-purin-6-on [German] [ACD/IUPAC Name]
2-Amino-9-[(2ξ)-3-amino-3-désoxy-β-D-thréo-pentofuranosyl]-1,9-dihydro-6H-purin-6-one [French] [ACD/IUPAC Name]
6H-Purin-6-one, 2-amino-9-[(2ξ)-3-amino-3-deoxy-β-D-threo-pentofuranosyl]-1,9-dihydro- [ACD/Index Name]
3'-Amino-3'-deoxyguanosine [ACD/IUPAC Name]
80015-76-5 [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.986
Molar Refractivity: 61.9±0.5 cm3
#H bond acceptors: 10
#H bond donors: 7
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 2
ACD/LogP: -0.85
ACD/LogD (pH 5.5): -3.70
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.03
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.13
Polar Surface Area: 161 Å2
Polarizability: 24.5±0.5 10-24cm3
Surface Tension: 127.6±7.0 dyne/cm
Molar Volume: 124.9±7.0 cm3

Click to predict properties on the Chemicalize site


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