ChemSpider 2D Image | 4-[3-(2-Furyl)-3-oxopropanoyl]-3-hydroxyphenyl beta-D-glucopyranoside | C19H20O10

4-[3-(2-Furyl)-3-oxopropanoyl]-3-hydroxyphenyl β-D-glucopyranoside

  • Molecular FormulaC19H20O10
  • Average mass408.356 Da
  • Monoisotopic mass408.105652 Da
  • ChemSpider ID31114170

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

1,3-Propanedione, 1-(2-furanyl)-3-[4-(β-D-glucopyranosyloxy)-2-hydroxyphenyl]- [ACD/Index Name]
4-[3-(2-Furyl)-3-oxopropanoyl]-3-hydroxyphenyl β-D-glucopyranoside [ACD/IUPAC Name]
4-[3-(2-Furyl)-3-oxopropanoyl]-3-hydroxyphenyl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
β-D-Glucopyranoside de 4-[3-(2-furyl)-3-oxopropanoyl]-3-hydroxyphényle [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 737.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 113.0±3.0 kJ/mol
Flash Point: 400.1±32.9 °C
Index of Refraction: 1.642
Molar Refractivity: 95.8±0.3 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: -0.27
ACD/LogD (pH 5.5): 0.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 29.44
ACD/LogD (pH 7.4): -0.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 14.53
Polar Surface Area: 167 Å2
Polarizability: 38.0±0.5 10-24cm3
Surface Tension: 71.8±3.0 dyne/cm
Molar Volume: 265.2±3.0 cm3

Click to predict properties on the Chemicalize site


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