ChemSpider 2D Image | 5-[Bis(2,2-dihydroxyvinyl)amino]-2,4,6(1H,3H,5H)-pyrimidinetrione | C8H9N3O7

5-[Bis(2,2-dihydroxyvinyl)amino]-2,4,6(1H,3H,5H)-pyrimidinetrione

  • Molecular FormulaC8H9N3O7
  • Average mass259.173 Da
  • Monoisotopic mass259.044037 Da
  • ChemSpider ID95768837

More details:

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

2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-[bis(2,2-dihydroxyethenyl)amino]- [ACD/Index Name]
5-[Bis(2,2-dihydroxyvinyl)amino]-2,4,6(1H,3H,5H)-pyrimidinetrione [ACD/IUPAC Name]
5-[Bis(2,2-dihydroxyvinyl)amino]-2,4,6(1H,3H,5H)-pyrimidinetrione [French] [ACD/IUPAC Name]
5-[Bis(2,2-dihydroxyvinyl)amino]-2,4,6(1H,3H,5H)-pyrimidintrion [German] [ACD/IUPAC Name]

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

Density: 2.0±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.749
Molar Refractivity: 54.1±0.4 cm3
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: -1.45
ACD/LogD (pH 5.5): -4.39
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.55
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 159 Å2
Polarizability: 21.4±0.5 10-24cm3
Surface Tension: 135.4±5.0 dyne/cm
Molar Volume: 132.8±5.0 cm3

Click to predict properties on the Chemicalize site


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