ChemSpider 2D Image | 5,7-Dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-3-yl 3,4-di-O-acetyl-6-deoxyhexopyranoside | C25H24O12

5,7-Dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-3-yl 3,4-di-O-acetyl-6-deoxyhexopyranoside

  • Molecular FormulaC25H24O12
  • Average mass516.451 Da
  • Monoisotopic mass516.127014 Da
  • ChemSpider ID21613100

More details:

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

3,4-Di-O-acétyl-6-désoxyhexopyranoside de 5,7-dihydroxy-2-(4-hydroxyphényl)-4-oxo-4H-chromén-3-yle [French] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 3-[(3,4-di-O-acetyl-6-deoxyhexopyranosyl)oxy]-5,7-dihydroxy-2-(4-hydroxyphenyl)- [ACD/Index Name]
5,7-Dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-3-yl 3,4-di-O-acetyl-6-deoxyhexopyranoside [ACD/IUPAC Name]
5,7-Dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-3-yl-3,4-di-O-acetyl-6-desoxyhexopyranosid [German] [ACD/IUPAC Name]
3-?[(3,?4-?DI-?O-?ACETYL-?6-?DEOXY-?α-?L-?MANNOPYRANOSYL)OXY]-?5,?7-?DIHYDROXY-?2-?(4-?HYDROXYPHENYL)-?4H-?1-?BENZOPYRAN-?4-?ONE
3-[(3,4-Di-O-acetyl-6-deoxy-a-L-mannopyranosyl)oxy]-5,7-dihydro-2-(4-hydroxyphenyl)-4H-1benzopyran-4-one
77307-50-7 [RN]
SL 0101-1
  • Experimental Physico-chemical Properties

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

Density: 1.6±0.0 g/cm3
Boiling Point: 753.0±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 113.6±0.0 kJ/mol
Flash Point: 255.6±0.0 °C
Index of Refraction: 1.665
Molar Refractivity: 122.1±0.0 cm3
#H bond acceptors: 12
#H bond donors: 4
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 2.75
ACD/LogD (pH 5.5): 2.64
ACD/BCF (pH 5.5): 55.84
ACD/KOC (pH 5.5): 574.59
ACD/LogD (pH 7.4): 1.15
ACD/BCF (pH 7.4): 1.83
ACD/KOC (pH 7.4): 18.85
Polar Surface Area: 178 Å2
Polarizability: 48.4±0.0 10-24cm3
Surface Tension: 81.6±0.0 dyne/cm
Molar Volume: 328.5±0.0 cm3

Click to predict properties on the Chemicalize site


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