ChemSpider 2D Image | 5-(Hydro)peroxoisourate | C5H4N4O5

5-(Hydro)peroxoisourate

  • Molecular FormulaC5H4N4O5
  • Average mass200.109 Da
  • Monoisotopic mass200.018173 Da
  • ChemSpider ID35033892

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(5S)-5-Hydroperoxy-5,7-dihydro-1H-purin-2,6,8(3H)-trion [German] [ACD/IUPAC Name]
(5S)-5-Hydroperoxy-5,7-dihydro-1H-purine-2,6,8(3H)-trione [ACD/IUPAC Name]
(5S)-5-Hydroperoxy-5,7-dihydro-1H-purine-2,6,8(3H)-trione [French] [ACD/IUPAC Name]
1H-Purine-2,6,8(3H)-trione, 5,7-dihydro-5-hydroperoxy-, (5S)- [ACD/Index Name]
5-(Hydro)peroxoisourate
IUP

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

Density: 2.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 2.003
Molar Refractivity: 38.0±0.5 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.61
ACD/LogD (pH 5.5): -2.16
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.05
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 129 Å2
Polarizability: 15.1±0.5 10-24cm3
Surface Tension: 168.6±7.0 dyne/cm
Molar Volume: 75.9±7.0 cm3

Click to predict properties on the Chemicalize site


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