ChemSpider 2D Image | 6,8-Dihydroxy-2-oxo-2H-chromen-7-yl beta-D-glucopyranoside | C15H16O10

6,8-Dihydroxy-2-oxo-2H-chromen-7-yl β-D-glucopyranoside

  • Molecular FormulaC15H16O10
  • Average mass356.281 Da
  • Monoisotopic mass356.074341 Da
  • ChemSpider ID57620849

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

2H-1-Benzopyran-2-one, 7-(β-D-glucopyranosyloxy)-6,8-dihydroxy- [ACD/Index Name]
6,8-Dihydroxy-2-oxo-2H-chromen-7-yl β-D-glucopyranoside [ACD/IUPAC Name]
6,8-Dihydroxy-2-oxo-2H-chromen-7-yl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
6,8-dihydroxy-7-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2H-chromen-2-one
6,8-dihydroxy-7-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-2-one
75872-12-7 [RN]
β-D-Glucopyranoside de 6,8-dihydroxy-2-oxo-2H-chromén-7-yle [French] [ACD/IUPAC Name]
7-?(?-?D-?glucopyranosyloxy)?-?6,?8-?dihydroxy-2H-?1-?Benzopyran-?2-?one

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

Density: 1.8±0.1 g/cm3
Boiling Point: 745.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 114.0±3.0 kJ/mol
Flash Point: 278.8±26.4 °C
Index of Refraction: 1.718
Molar Refractivity: 79.2±0.3 cm3
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: -3.59
ACD/LogD (pH 5.5): -2.31
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.28
ACD/LogD (pH 7.4): -3.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 166 Å2
Polarizability: 31.4±0.5 10-24cm3
Surface Tension: 105.2±3.0 dyne/cm
Molar Volume: 201.0±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement