ChemSpider 2D Image | 5-Fluoro-1-[3-C-(hydroxymethyl)-beta-D-glucopyranosyl]-2,4(1H,3H)-pyrimidinedione | C11H15FN2O8

5-Fluoro-1-[3-C-(hydroxymethyl)-β-D-glucopyranosyl]-2,4(1H,3H)-pyrimidinedione

  • Molecular FormulaC11H15FN2O8
  • Average mass322.244 Da
  • Monoisotopic mass322.081238 Da
  • ChemSpider ID35035985

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

2,4(1H,3H)-Pyrimidinedione, 5-fluoro-1-[3-C-(hydroxymethyl)-β-D-glucopyranosyl]- [ACD/Index Name]
5-Fluor-1-[3-C-(hydroxymethyl)-β-D-glucopyranosyl]-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]
5-Fluoro-1-[3-C-(hydroxymethyl)-β-D-glucopyranosyl]-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
5-Fluoro-1-[3-C-(hydroxyméthyl)-β-D-glucopyranosyl]-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]
5-Fluoro-1-[3-C-(Hydroxymethyl)-β-D-Glucopyranosyl]pyrimidine-2,4(1h,3h)-Dione
GP0

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

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.671
Molar Refractivity: 65.8±0.4 cm3
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: -0.42
ACD/LogD (pH 5.5): -1.34
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.45
ACD/LogD (pH 7.4): -1.57
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.58
Polar Surface Area: 160 Å2
Polarizability: 26.1±0.5 10-24cm3
Surface Tension: 105.1±5.0 dyne/cm
Molar Volume: 175.8±5.0 cm3

Click to predict properties on the Chemicalize site


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