ChemSpider 2D Image | 3-(beta-D-Glucopyranosyl)-6-pentylfuro[2,3-d]pyrimidin-2(3H)-one | C17H24N2O7

3-(β-D-Glucopyranosyl)-6-pentylfuro[2,3-d]pyrimidin-2(3H)-one

  • Molecular FormulaC17H24N2O7
  • Average mass368.382 Da
  • Monoisotopic mass368.158356 Da
  • ChemSpider ID28511526

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

3-(β-D-Glucopyranosyl)-6-pentylfuro[2,3-d]pyrimidin-2(3H)-on [German] [ACD/IUPAC Name]
3-(β-D-Glucopyranosyl)-6-pentylfuro[2,3-d]pyrimidin-2(3H)-one [ACD/IUPAC Name]
3-(β-D-Glucopyranosyl)-6-pentylfuro[2,3-d]pyrimidin-2(3H)-one [French] [ACD/IUPAC Name]
Furo[2,3-d]pyrimidin-2(3H)-one, 3-β-D-glucopyranosyl-6-pentyl- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 606.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.9 mmHg at 25°C
Enthalpy of Vaporization: 103.4±6.0 kJ/mol
Flash Point: 320.7±34.3 °C
Index of Refraction: 1.665
Molar Refractivity: 87.1±0.5 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.38
ACD/LogD (pH 5.5): 0.30
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 34.80
ACD/LogD (pH 7.4): 0.30
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 34.80
Polar Surface Area: 132 Å2
Polarizability: 34.5±0.5 10-24cm3
Surface Tension: 62.3±7.0 dyne/cm
Molar Volume: 234.7±7.0 cm3

Click to predict properties on the Chemicalize site


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