ChemSpider 2D Image | 4-[5-Hydroxy-7-(octyloxy)-4-oxo-4H-chromen-3-yl]phenyl hexopyranoside | C29H36O10

4-[5-Hydroxy-7-(octyloxy)-4-oxo-4H-chromen-3-yl]phenyl hexopyranoside

  • Molecular FormulaC29H36O10
  • Average mass544.590 Da
  • Monoisotopic mass544.230835 Da
  • ChemSpider ID4803162

More details:






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

4-[5-Hydroxy-7-(octyloxy)-4-oxo-4H-chromen-3-yl]phenyl hexopyranoside [ACD/IUPAC Name]
4-[5-Hydroxy-7-(octyloxy)-4-oxo-4H-chromen-3-yl]phenylhexopyranosid [German] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 3-[4-(hexopyranosyloxy)phenyl]-5-hydroxy-7-(octyloxy)- [ACD/Index Name]
Hexopyranoside de 4-[5-hydroxy-7-(octyloxy)-4-oxo-4H-chromén-3-yl]phényle [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 777.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 118.7±3.0 kJ/mol
Flash Point: 254.4±26.4 °C
Index of Refraction: 1.614
Molar Refractivity: 140.9±0.3 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: 4.60
ACD/LogD (pH 5.5): 3.90
ACD/BCF (pH 5.5): 521.67
ACD/KOC (pH 5.5): 2945.31
ACD/LogD (pH 7.4): 2.84
ACD/BCF (pH 7.4): 46.07
ACD/KOC (pH 7.4): 260.09
Polar Surface Area: 155 Å2
Polarizability: 55.9±0.5 10-24cm3
Surface Tension: 62.7±3.0 dyne/cm
Molar Volume: 404.3±3.0 cm3

Click to predict properties on the Chemicalize site






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