ChemSpider 2D Image | 9-[(2R,5S)-5-(Hydroxymethyl)tetrahydro-2-furanyl](4,5-~13~C_2_,7-~15~N)-1,9-dihydro-6H-purin-6-one | C813C2H12N315NO3

9-[(2R,5S)-5-(Hydroxymethyl)tetrahydro-2-furanyl](4,5-13C2,7-15N)-1,9-dihydro-6H-purin-6-one

  • Molecular FormulaC813C2H12N315NO3
  • Average mass239.206 Da
  • Monoisotopic mass239.094681 Da
  • ChemSpider ID58780959

  • defined stereocentres - 2 of 2 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

6H-Purin-6-one-4,5-13C2-7-15N, 1,9-dihydro-9-[(2R,5S)-tetrahydro-5-(hydroxymethyl)-2-furanyl]- [ACD/Index Name]
9-[(2R,5S)-5-(Hydroxymethyl)tetrahydro-2-furanyl](4,5-13C2,7-15N)-1,9-dihydro-6H-purin-6-on [German] [ACD/IUPAC Name]
9-[(2R,5S)-5-(Hydroxymethyl)tetrahydro-2-furanyl](4,5-13C2,7-15N)-1,9-dihydro-6H-purin-6-one [ACD/IUPAC Name]
9-[(2R,5S)-5-(Hydroxyméthyl)tétrahydro-2-furanyl](4,5-13C2,7-15N)-1,9-dihydro-6H-purin-6-one [French] [ACD/IUPAC Name]

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: 1.798
Molar Refractivity: 57.2±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: 22.7±0.5 10-24cm3
Surface Tension: 79.2±7.0 dyne/cm
Molar Volume: 134.1±7.0 cm3

Click to predict properties on the Chemicalize site


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