ChemSpider 2D Image | (6-~13~C,3,6-~2~H_2_,1,2-~15~N_2_)-1,7-Dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one | C413CH2D2N215N2O


  • Molecular FormulaC413CH2D2N215N2O
  • Average mass141.103 Da
  • Monoisotopic mass141.048492 Da
  • ChemSpider ID107435486
  • Non-standard isotope - Non-standard isotope

More details:

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

(6-13C,3,6-2H2,1,2-15N2)-1,7-Dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-on [German] [ACD/IUPAC Name]
(6-13C,3,6-2H2,1,2-15N2)-1,7-Dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one [ACD/IUPAC Name]
(6-13C,3,6-2H2,1,2-15N2)-1,7-Dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one [French] [ACD/IUPAC Name]
4H-Pyrazolo[3,4-d]pyrimidin-4-one-6-13C-3,6-d2-1,2-15N2, 1,7-dihydro- [ACD/Index Name]

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

Density: 1.9±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.903
Molar Refractivity: 33.6±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: 13.3±0.5 10-24cm3
Surface Tension: 91.4±7.0 dyne/cm
Molar Volume: 72.0±7.0 cm3

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