ChemSpider 2D Image | 2-(~15~N)Amino-9-[(2xi)-beta-D-threo-pentofuranosyl](2-~13~C,1-~15~N)-3,9-dihydro-6H-purin-6-one | C913CH13N315N2O5

2-(15N)Amino-9-[(2ξ)-β-D-threo-pentofuranosyl](2-13C,1-15N)-3,9-dihydro-6H-purin-6-one

  • Molecular FormulaC913CH13N315N2O5
  • Average mass286.220 Da
  • Monoisotopic mass286.089081 Da
  • ChemSpider ID57550000
  • defined stereocentres - 3 of 4 defined stereocentres

    Non-standard isotope - Non-standard isotope


More details:






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

2-(15N)Amino-9-[(2ξ)-β-D-threo-pentofuranosyl](2-13C,1-15N)-3,9-dihydro-6H-purin-6-on [German] [ACD/IUPAC Name]
2-(15N)Amino-9-[(2ξ)-β-D-threo-pentofuranosyl](2-13C,1-15N)-3,9-dihydro-6H-purin-6-one [ACD/IUPAC Name]
2-(15N)Amino-9-[(2ξ)-β-D-thréo-pentofuranosyl](2-13C,1-15N)-3,9-dihydro-6H-purin-6-one [French] [ACD/IUPAC Name]
6H-Purin-6-one-2-13C-1-15N, 2-(amino-15N)-3,9-dihydro-9-[(2ξ)-β-D-threo-pentofuranosyl]- [ACD/Index Name]
197227-95-5 [RN]
2-(15N)Azanyl-9-[(2R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1H-purin-6-one

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

Density: 2.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.955
Molar Refractivity: 60.8±0.5 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
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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