ChemSpider 2D Image | 1-(2-Bromo-2-deoxy-beta-D-xylofuranosyl)-2,4(1H,3H)-pyrimidinedione | C9H11BrN2O5

1-(2-Bromo-2-deoxy-β-D-xylofuranosyl)-2,4(1H,3H)-pyrimidinedione

  • Molecular FormulaC9H11BrN2O5
  • Average mass307.098 Da
  • Monoisotopic mass305.985138 Da
  • ChemSpider ID24679337

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

1-(2-Brom-2-desoxy-β-D-xylofuranosyl)-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]
1-(2-Bromo-2-deoxy-β-D-xylofuranosyl)-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
1-(2-Bromo-2-désoxy-β-D-xylofuranosyl)-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]
2,4(1H,3H)-Pyrimidinedione, 1-(2-bromo-2-deoxy-β-D-xylofuranosyl)- [ACD/Index Name]

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

Density: 1.9±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.642
Molar Refractivity: 58.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.93
ACD/LogD (pH 5.5): -1.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.07
ACD/LogD (pH 7.4): -1.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.01
Polar Surface Area: 99 Å2
Polarizability: 23.4±0.5 10-24cm3
Surface Tension: 76.8±3.0 dyne/cm
Molar Volume: 163.2±3.0 cm3

Click to predict properties on the Chemicalize site


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