ChemSpider 2D Image | 1,3,7-Trimethyl(~3~H)-3,7-dihydro-1H-purine-2,6-dione | C8H9TN4O2

1,3,7-Trimethyl(3H)-3,7-dihydro-1H-purine-2,6-dione

  • Molecular FormulaC8H9TN4O2
  • Average mass196.199 Da
  • Monoisotopic mass196.088593 Da
  • ChemSpider ID110406473
  • Non-standard isotope - Non-standard isotope


More details:






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

1,3,7-Trimethyl(3H)-3,7-dihydro-1H-purin-2,6-dion [German] [ACD/IUPAC Name]
1,3,7-Trimethyl(3H)-3,7-dihydro-1H-purine-2,6-dione [ACD/IUPAC Name]
1,3,7-Triméthyl(3H)-3,7-dihydro-1H-purine-2,6-dione [French] [ACD/IUPAC Name]
1H-Purine-2,6-dione-8-t, 3,7-dihydro-1,3,7-trimethyl- [ACD/Index Name]

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

Density:
Boiling Point: 416.8±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.0±3.0 kJ/mol
Flash Point: 205.9±26.5 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -0.13
ACD/LogD (pH 5.5): 0.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 34.00
ACD/LogD (pH 7.4): 0.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 34.00
Polar Surface Area: 58 Å2
Polarizability:
Surface Tension:
Molar Volume:

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