ChemSpider 2D Image | 3,7-Bis[(6-deoxyhexopyranosyl)oxy]-2-(3,4-dihydroxyphenyl)-4-oxo-6,7-dihydro-4H-chromen-5-olate | C27H31O15

3,7-Bis[(6-deoxyhexopyranosyl)oxy]-2-(3,4-dihydroxyphenyl)-4-oxo-6,7-dihydro-4H-chromen-5-olate

  • Molecular FormulaC27H31O15
  • Average mass595.527 Da
  • Monoisotopic mass595.166870 Da
  • ChemSpider ID24785074

  • Charge - Charge

More details:

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

3,7-Bis[(6-deoxyhexopyranosyl)oxy]-2-(3,4-dihydroxyphenyl)-4-oxo-6,7-dihydro-4H-chromen-5-olate [ACD/IUPAC Name]
3,7-Bis[(6-desoxyhexopyranosyl)oxy]-2-(3,4-dihydroxyphenyl)-4-oxo-6,7-dihydro-4H-chromen-5-olat [German] [ACD/IUPAC Name]
3,7-Bis[(6-désoxyhexopyranosyl)oxy]-2-(3,4-dihydroxyphényl)-4-oxo-6,7-dihydro-4H-chromén-5-olate [French] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 3,7-bis[(6-deoxyhexopyranosyl)oxy]-2-(3,4-dihydroxyphenyl)-6,7-dihydro-5-hydroxy-, ion(1-) [ACD/Index Name]
quercetin-3-O-rhamnoside-7-O-rhamnoside*quercetin-3-O-rhamnoside-7-O-rhamnoside
quercetin-3-rhamnoside-7-rhamnoside

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

Density:
Boiling Point: 965.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 147.4±3.0 kJ/mol
Flash Point: 320.0±27.8 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 15
#H bond donors: 9
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 3
ACD/LogP: 1.47
ACD/LogD (pH 5.5): -1.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.66
ACD/LogD (pH 7.4): -3.02
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 248 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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