ChemSpider 2D Image | 3',5'-Dihydroxy-1,1':4',1''-terphenyl-2'-yl beta-D-glucopyranosiduronic acid | C24H22O9

3',5'-Dihydroxy-1,1':4',1''-terphenyl-2'-yl β-D-glucopyranosiduronic acid

  • Molecular FormulaC24H22O9
  • Average mass454.426 Da
  • Monoisotopic mass454.126373 Da
  • ChemSpider ID23550580

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

3',5'-Dihydroxy-1,1':4',1''-terphenyl-2'-yl β-D-glucopyranosiduronic acid [ACD/IUPAC Name]
3',5'-Dihydroxy-1,1':4',1''-terphenyl-2'-yl-β-D-glucopyranosiduronsäure [German] [ACD/IUPAC Name]
Acide β-D-glucopyranosiduronique de 3',5'-dihydroxy-1,1':4',1''-terphényl-2'-yle [French] [ACD/IUPAC Name]
β-D-Glucopyranosiduronic acid, 3',5'-dihydroxy[1,1':4',1''-terphenyl]-2'-yl [ACD/Index Name]
echoside C

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

Density: 1.5±0.1 g/cm3
Boiling Point: 755.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 115.5±3.0 kJ/mol
Flash Point: 262.9±26.4 °C
Index of Refraction: 1.698
Molar Refractivity: 114.8±0.3 cm3
#H bond acceptors: 9
#H bond donors: 6
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 0.21
ACD/LogD (pH 5.5): -2.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.92
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 157 Å2
Polarizability: 45.5±0.5 10-24cm3
Surface Tension: 81.0±3.0 dyne/cm
Molar Volume: 297.6±3.0 cm3

Click to predict properties on the Chemicalize site


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