ChemSpider 2D Image | 2-Hydroxy-2-(4-hydroxy-3-methoxyphenyl)ethyl hexopyranosiduronic acid | C15H20O10

2-Hydroxy-2-(4-hydroxy-3-methoxyphenyl)ethyl hexopyranosiduronic acid

  • Molecular FormulaC15H20O10
  • Average mass360.313 Da
  • Monoisotopic mass360.105652 Da
  • ChemSpider ID21428956

More details:

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

2-Hydroxy-2-(4-hydroxy-3-methoxyphenyl)ethyl hexopyranosiduronic acid [ACD/IUPAC Name]
2-Hydroxy-2-(4-hydroxy-3-methoxyphenyl)ethylhexopyranosiduronsäure [German] [ACD/IUPAC Name]
3,4,5-Trihydroxy-6-[2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)ethoxy]tetrahydro-2H-pyran-2-carbonsäure [German]
3,4,5-Trihydroxy-6-[2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)ethoxy]tetrahydro-2H-pyran-2-carboxylic acid
Acide 3,4,5-trihydroxy-6-[2-hydroxy-2-(4-hydroxy-3-méthoxyphényl)éthoxy]tétrahydro-2H-pyran-2-carboxylique [French]
Acide hexopyranosiduronique de 2-hydroxy-2-(4-hydroxy-3-méthoxyphényl)éthyle [French] [ACD/IUPAC Name]
Hexopyranosiduronic acid, 2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)ethyl [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 681.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 104.9±3.0 kJ/mol
Flash Point: 251.5±25.0 °C
Index of Refraction: 1.649
Molar Refractivity: 80.8±0.4 cm3
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: -2.56
ACD/LogD (pH 5.5): -4.95
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.84
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 166 Å2
Polarizability: 32.0±0.5 10-24cm3
Surface Tension: 92.3±5.0 dyne/cm
Molar Volume: 221.7±5.0 cm3

Click to predict properties on the Chemicalize site


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