ChemSpider 2D Image | 5,6,7-Trihydroxy-2-(2,4,5-trihydroxyphenyl)-4H-chromen-4-one | C15H10O8

5,6,7-Trihydroxy-2-(2,4,5-trihydroxyphenyl)-4H-chromen-4-one

  • Molecular FormulaC15H10O8
  • Average mass318.235 Da
  • Monoisotopic mass318.037567 Da
  • ChemSpider ID28713318

More details:

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

4H-1-Benzopyran-4-one, 5,6,7-trihydroxy-2-(2,4,5-trihydroxyphenyl)- [ACD/Index Name]
5,6,7-Trihydroxy-2-(2,4,5-trihydroxyphenyl)-4H-chromen-4-on [German] [ACD/IUPAC Name]
5,6,7-Trihydroxy-2-(2,4,5-trihydroxyphenyl)-4H-chromen-4-one [ACD/IUPAC Name]
5,6,7-Trihydroxy-2-(2,4,5-trihydroxyphényl)-4H-chromén-4-one [French] [ACD/IUPAC Name]
5,6,7-Trihydroxy-2-(2,4,5-trihydroxyphenyl)-4H-1-benzopyran-4-one
5,6,7-trihydroxy-2-(2,4,5-trihydroxyphenyl)chromen-4-one
96203-58-6 [RN]

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: 1.9±0.1 g/cm3
Boiling Point: 781.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 117.6±3.0 kJ/mol
Flash Point: 298.0±26.4 °C
Index of Refraction: 1.844
Molar Refractivity: 75.5±0.3 cm3
#H bond acceptors: 8
#H bond donors: 6
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: 2.29
ACD/LogD (pH 5.5): 1.77
ACD/BCF (pH 5.5): 12.39
ACD/KOC (pH 5.5): 198.01
ACD/LogD (pH 7.4): 0.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 8.14
Polar Surface Area: 148 Å2
Polarizability: 29.9±0.5 10-24cm3
Surface Tension: 124.2±3.0 dyne/cm
Molar Volume: 169.9±3.0 cm3

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