ChemSpider 2D Image | 5,7-Dimethoxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-3-yl 6-deoxy-2-O-(6-deoxy-alpha-L-mannopyranosyl)-alpha-L-mannopyranoside | C30H36O14

5,7-Dimethoxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-3-yl 6-deoxy-2-O-(6-deoxy-α-L-mannopyranosyl)-α-L-mannopyranoside

  • Molecular FormulaC30H36O14
  • Average mass620.598 Da
  • Monoisotopic mass620.210510 Da
  • ChemSpider ID8683518

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

4H-1-Benzopyran-4-one, 3-[[6-deoxy-2-O-(6-deoxy-α-L-mannopyranosyl)-α-L-mannopyranosyl]oxy]-5,7-dimethoxy-2-(4-methoxyphenyl)- [ACD/Index Name]
5,7-Dimethoxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-3-yl 6-deoxy-2-O-(6-deoxy-α-L-mannopyranosyl)-α-L-mannopyranoside [ACD/IUPAC Name]
5,7-Dimethoxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-3-yl-6-desoxy-2-O-(6-desoxy-α-L-mannopyranosyl)-α-L-mannopyranosid [German] [ACD/IUPAC Name]
6-Désoxy-2-O-(6-désoxy-α-L-mannopyranosyl)-α-L-mannopyranoside de 5,7-diméthoxy-2-(4-méthoxyphényl)-4-oxo-4H-chromén-3-yle [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: 857.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 130.5±3.0 kJ/mol
Flash Point: 277.5±27.8 °C
Index of Refraction: 1.641
Molar Refractivity: 149.6±0.4 cm3
#H bond acceptors: 14
#H bond donors: 5
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: 3.35
ACD/LogD (pH 5.5): 1.53
ACD/BCF (pH 5.5): 8.52
ACD/KOC (pH 5.5): 161.32
ACD/LogD (pH 7.4): 1.53
ACD/BCF (pH 7.4): 8.52
ACD/KOC (pH 7.4): 161.32
Polar Surface Area: 192 Å2
Polarizability: 59.3±0.5 10-24cm3
Surface Tension: 74.0±5.0 dyne/cm
Molar Volume: 414.5±5.0 cm3

Click to predict properties on the Chemicalize site


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