ChemSpider 2D Image | 8-Methoxy-3-methyl-7,12-dioxo-7,12-dihydro-1-tetraphenyl beta-D-glucopyranosiduronic acid | C26H22O10

8-Methoxy-3-methyl-7,12-dioxo-7,12-dihydro-1-tetraphenyl β-D-glucopyranosiduronic acid

  • Molecular FormulaC26H22O10
  • Average mass494.447 Da
  • Monoisotopic mass494.121307 Da
  • ChemSpider ID28670253

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

8-Methoxy-3-methyl-7,12-dioxo-7,12-dihydro-1-tetraphenyl β-D-glucopyranosiduronic acid [ACD/IUPAC Name]
8-Methoxy-3-methyl-7,12-dioxo-7,12-dihydro-1-tetraphenyl-β-D-glucopyranosiduronsäure [German] [ACD/IUPAC Name]
Acide β-D-glucopyranosiduronique de 8-méthoxy-3-méthyl-7,12-dioxo-7,12-dihydro-1-tétraphényle [French] [ACD/IUPAC Name]
Benz[a]anthracene-7,12-dione, 1-(β-D-glucopyranuronosyloxy)-8-methoxy-3-methyl- [ACD/Index Name]
Pseudonocardone B

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

Density: 1.6±0.1 g/cm3
Boiling Point: 844.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 128.6±3.0 kJ/mol
Flash Point: 290.6±27.8 °C
Index of Refraction: 1.716
Molar Refractivity: 123.6±0.3 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 2.00
ACD/LogD (pH 5.5): -0.94
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.78
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 160 Å2
Polarizability: 49.0±0.5 10-24cm3
Surface Tension: 83.4±3.0 dyne/cm
Molar Volume: 314.2±3.0 cm3

Click to predict properties on the Chemicalize site


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