ChemSpider 2D Image | 7-(2,3-Dihydroxypropyl)-3-methyl-8-(methylamino)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-9-ium | C10H16N5O4


  • Molecular FormulaC10H16N5O4
  • Average mass270.265 Da
  • Monoisotopic mass270.119690 Da
  • ChemSpider ID21203029
  • Charge - Charge

More details:

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

1H-Purinium, 7-(2,3-dihydroxypropyl)-2,3,6,7-tetrahydro-3-methyl-8-(methylamino)-2,6-dioxo- [ACD/Index Name]
7-(2,3-Dihydroxypropyl)-3-methyl-8-(methylamino)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-9-ium [ACD/IUPAC Name]
7-(2,3-Dihydroxypropyl)-3-methyl-8-(methylamino)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-9-ium [German] [ACD/IUPAC Name]
7-(2,3-Dihydroxypropyl)-3-méthyl-8-(méthylamino)-2,6-dioxo-2,3,6,7-tétrahydro-1H-purin-9-ium [French] [ACD/IUPAC Name]

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

Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -1.83
ACD/LogD (pH 5.5): -1.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.70
ACD/LogD (pH 7.4): -1.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.68
Polar Surface Area: 121 Å2
Surface Tension:
Molar Volume:

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