ChemSpider 2D Image | 2-(5-O-Phosphono-beta-D-ribofuranosyl)-1,2,4-triazine-3,5(2H,4H)-dione | C8H12N3O9P

2-(5-O-Phosphono-β-D-ribofuranosyl)-1,2,4-triazine-3,5(2H,4H)-dione

  • Molecular FormulaC8H12N3O9P
  • Average mass325.169 Da
  • Monoisotopic mass325.031128 Da
  • ChemSpider ID29787314

  • defined stereocentres - 2 of 4 defined stereocentres

More details:

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

1,2,4-Triazine-3,5(2H,4H)-dione, 2-(5-O-phosphono-β-D-ribofuranosyl)- [ACD/Index Name]
2-(5-O-Phosphono-β-D-ribofuranosyl)-1,2,4-triazin-3,5(2H,4H)-dion [German] [ACD/IUPAC Name]
2-(5-O-Phosphono-β-D-ribofuranosyl)-1,2,4-triazine-3,5(2H,4H)-dione [ACD/IUPAC Name]
2-(5-O-Phosphono-β-D-ribofuranosyl)-1,2,4-triazine-3,5(2H,4H)-dione [French] [ACD/IUPAC Name]
2018-19-1 [RN]

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

Density: 2.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.810
Molar Refractivity: 60.0±0.5 cm3
#H bond acceptors: 12
#H bond donors: 5
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: -2.04
ACD/LogD (pH 5.5): -5.74
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.82
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 188 Å2
Polarizability: 23.8±0.5 10-24cm3
Surface Tension: 139.0±7.0 dyne/cm
Molar Volume: 139.1±7.0 cm3

Click to predict properties on the Chemicalize site


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