ChemSpider 2D Image | (8-~3~H)-1,7-Dihydro-6H-purin-6-one | C5H3TN4O

(8-3H)-1,7-Dihydro-6H-purin-6-one

  • Molecular FormulaC5H3TN4O
  • Average mass138.120 Da
  • Monoisotopic mass138.046738 Da
  • ChemSpider ID110406437
  • Non-standard isotope - Non-standard isotope


More details:






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

(8-3H)-1,7-Dihydro-6H-purin-6-on [German] [ACD/IUPAC Name]
(8-3H)-1,7-Dihydro-6H-purin-6-one [ACD/IUPAC Name]
(8-3H)-1,7-Dihydro-6H-purin-6-one [French] [ACD/IUPAC Name]
6H-Purin-6-one-8-t, 1,7-dihydro- [ACD/Index Name]

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

Density:
Boiling Point: 641.5±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.7±3.0 kJ/mol
Flash Point: 341.7±24.0 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -1.19
ACD/LogD (pH 5.5): -1.07
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.24
ACD/LogD (pH 7.4): -1.07
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.22
Polar Surface Area: 70 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site






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