ChemSpider 2D Image | 2-Amino-9-[(1S,3R,4R)-4-hydroxy-3-(hydroxymethyl)-2-methylenecyclopentyl](4,6-~13~C_2_,7-~15~N)-1,9-dihydro-6H-purin-6-one | C1013C2H15N415NO3

2-Amino-9-[(1S,3R,4R)-4-hydroxy-3-(hydroxymethyl)-2-methylenecyclopentyl](4,6-13C2,7-15N)-1,9-dihydro-6H-purin-6-one

  • Molecular FormulaC1013C2H15N415NO3
  • Average mass280.258 Da
  • Monoisotopic mass280.121246 Da
  • ChemSpider ID48061319

  • defined stereocentres - 3 of 3 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

2-Amino-9-[(1S,3R,4R)-4-hydroxy-3-(hydroxymethyl)-2-methylencyclopentyl](4,6-13C2,7-15N)-1,9-dihydro-6H-purin-6-on [German] [ACD/IUPAC Name]
2-Amino-9-[(1S,3R,4R)-4-hydroxy-3-(hydroxymethyl)-2-methylenecyclopentyl](4,6-13C2,7-15N)-1,9-dihydro-6H-purin-6-one [ACD/IUPAC Name]
2-Amino-9-[(1S,3R,4R)-4-hydroxy-3-(hydroxyméthyl)-2-méthylènecyclopentyl](4,6-13C2,7-15N)-1,9-dihydro-6H-purin-6-one [French] [ACD/IUPAC Name]
6H-Purin-6-one-4,6-13C2-7-15N, 2-amino-1,9-dihydro-9-[(1S,3R,4R)-4-hydroxy-3-(hydroxymethyl)-2-methylenecyclopentyl]- [ACD/Index Name]
1329796-53-3 [RN]
2-amino-9-[(1S,3R,4R)-4-hydroxy-3-(hydroxymethyl)-2-methylidenecyclopentyl]-3H-purin-6-one
entecavir-13c2,15n

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

    Density: 1.8±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.837
    Molar Refractivity: 67.6±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: 26.8±0.5 10-24cm3
    Surface Tension: 84.2±7.0 dyne/cm
    Molar Volume: 153.0±7.0 cm3

    Click to predict properties on the Chemicalize site


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