ChemSpider 2D Image | 4-Amino-1-(2-deoxy-beta-L-erythro-pentofuranosyl)-5-hydroxy-2(1H)-(2-~13~C,~15~N_2_)pyrimidinone | C813CH13N15N2O5


  • Molecular FormulaC813CH13N15N2O5
  • Average mass246.196 Da
  • Monoisotopic mass246.082947 Da
  • ChemSpider ID111313064
  • 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(1H)-Pyrimidinone-2-13C-1,3-15N2, 4-amino-1-(2-deoxy-β-L-erythro-pentofuranosyl)-5-hydroxy- [ACD/Index Name]
4-Amino-1-(2-deoxy-β-L-erythro-pentofuranosyl)-5-hydroxy-2(1H)-(2-13C,15N2)pyrimidinone [ACD/IUPAC Name]
4-Amino-1-(2-desoxy-β-L-erythro-pentofuranosyl)-5-hydroxy-2(1H)-(2-13C,15N2)pyrimidinon [German] [ACD/IUPAC Name]
4-Amino-1-(2-désoxy-β-L-érythro-pentofuranosyl)-5-hydroxy-2(1H)-(2-13C,15N2)pyrimidinone [French] [ACD/IUPAC Name]

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

Density: 1.9±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.756
Molar Refractivity: 52.6±0.5 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
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: 20.9±0.5 10-24cm3
Surface Tension: 89.6±7.0 dyne/cm
Molar Volume: 128.4±7.0 cm3

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