ChemSpider 2D Image | 3-(3,4-Dihydroxy-5-methoxyphenyl)-1-(2,4,6-trihydroxy-3-methoxyphenyl)-1,2-propanedione | C17H16O9

3-(3,4-Dihydroxy-5-methoxyphenyl)-1-(2,4,6-trihydroxy-3-methoxyphenyl)-1,2-propanedione

  • Molecular FormulaC17H16O9
  • Average mass364.303 Da
  • Monoisotopic mass364.079437 Da
  • ChemSpider ID74852344

More details:

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

1,2-Propanedione, 3-(3,4-dihydroxy-5-methoxyphenyl)-1-(2,4,6-trihydroxy-3-methoxyphenyl)- [ACD/Index Name]
3-(3,4-Dihydroxy-5-methoxyphenyl)-1-(2,4,6-trihydroxy-3-methoxyphenyl)-1,2-propandion [German] [ACD/IUPAC Name]
3-(3,4-Dihydroxy-5-methoxyphenyl)-1-(2,4,6-trihydroxy-3-methoxyphenyl)-1,2-propanedione [ACD/IUPAC Name]
3-(3,4-Dihydroxy-5-méthoxyphényl)-1-(2,4,6-trihydroxy-3-méthoxyphényl)-1,2-propanedione [French] [ACD/IUPAC Name]
3-(3,4-dihydroxy-5-methoxyphenyl)-1-(2,4,6-trihydroxy-3-methoxyphenyl)propane-1,2-dione

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

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

Density: 1.5±0.1 g/cm3
Boiling Point: 651.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 99.4±3.0 kJ/mol
Flash Point: 239.0±25.0 °C
Index of Refraction: 1.672
Molar Refractivity: 88.2±0.3 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 0.95
ACD/LogD (pH 5.5): 1.04
ACD/BCF (pH 5.5): 3.06
ACD/KOC (pH 5.5): 63.67
ACD/LogD (pH 7.4): -1.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 154 Å2
Polarizability: 35.0±0.5 10-24cm3
Surface Tension: 77.2±3.0 dyne/cm
Molar Volume: 235.4±3.0 cm3

Click to predict properties on the Chemicalize site


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