ChemSpider 2D Image | 4-(beta-L-Xylofuranosyl)-1,2,4-triazin-3(4H)-one 1-oxide | C8H11N3O6

4-(β-L-Xylofuranosyl)-1,2,4-triazin-3(4H)-one 1-oxide

  • Molecular FormulaC8H11N3O6
  • Average mass245.189 Da
  • Monoisotopic mass245.064789 Da
  • ChemSpider ID62480540

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

1,2,4-Triazin-3(4H)-one, 4-β-L-xylofuranosyl-, 1-oxide [ACD/Index Name]
1-Oxyde de 4-(β-L-xylofuranosyl)-1,2,4-triazin-3(4H)-one [French] [ACD/IUPAC Name]
4-(β-L-Xylofuranosyl)-1,2,4-triazin-3(4H)-on-1-oxid [German] [ACD/IUPAC Name]
4-(β-L-Xylofuranosyl)-1,2,4-triazin-3(4H)-one 1-oxide [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: 545.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 94.7±6.0 kJ/mol
Flash Point: 283.5±32.9 °C
Index of Refraction: 1.761
Molar Refractivity: 50.9±0.5 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -2.04
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 131 Å2
Polarizability: 20.2±0.5 10-24cm3
Surface Tension: 98.1±7.0 dyne/cm
Molar Volume: 123.6±7.0 cm3

Click to predict properties on the Chemicalize site


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