ChemSpider 2D Image | 6-Amino-9-[(3xi)-beta-D-threo-pentofuranosyl]-9H-purin-8-ol | C10H13N5O5

6-Amino-9-[(3ξ)-β-D-threo-pentofuranosyl]-9H-purin-8-ol

  • Molecular FormulaC10H13N5O5
  • Average mass283.241 Da
  • Monoisotopic mass283.091675 Da
  • ChemSpider ID64860098

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

6-Amino-9-[(3ξ)-β-D-threo-pentofuranosyl]-9H-purin-8-ol [German] [ACD/IUPAC Name]
6-Amino-9-[(3ξ)-β-D-threo-pentofuranosyl]-9H-purin-8-ol [ACD/IUPAC Name]
6-Amino-9-[(3ξ)-β-D-thréo-pentofuranosyl]-9H-purin-8-ol [French] [ACD/IUPAC Name]
9H-Purin-8-ol, 6-amino-9-[(3ξ)-β-D-threo-pentofuranosyl]- [ACD/Index Name]
29851-57-8 [RN]
6-amino-9-[(2R,3S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-7H-purin-8-one
8-Oxoadenosine
MFCD15145291

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

Density: 2.3±0.1 g/cm3
Boiling Point: 776.3±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 118.5±3.0 kJ/mol
Flash Point: 423.3±35.7 °C
Index of Refraction: 1.955
Molar Refractivity: 60.8±0.5 cm3
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 2
ACD/LogP: -1.60
ACD/LogD (pH 5.5): -1.65
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.58
ACD/LogD (pH 7.4): -2.08
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 160 Å2
Polarizability: 24.1±0.5 10-24cm3
Surface Tension: 123.8±7.0 dyne/cm
Molar Volume: 125.4±7.0 cm3

Click to predict properties on the Chemicalize site


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