ChemSpider 2D Image | 6-[6-(5,7-Dihydroxy-4-oxo-4H-chromen-2-yl)-2,3-dihydroxyphenyl]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-chromen-4-one | C30H18O12

6-[6-(5,7-Dihydroxy-4-oxo-4H-chromen-2-yl)-2,3-dihydroxyphenyl]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-chromen-4-one

  • Molecular FormulaC30H18O12
  • Average mass570.457 Da
  • Monoisotopic mass570.079834 Da
  • ChemSpider ID4579658

More details:






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

4H-1-Benzopyran-4-one, 6-[6-(5,7-dihydroxy-4-oxo-4H-1-benzopyran-2-yl)-2,3-dihydroxyphenyl]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy- [ACD/Index Name]
6-[6-(5,7-Dihydroxy-4-oxo-4H-chromen-2-yl)-2,3-dihydroxyphenyl]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-chromen-4-on [German] [ACD/IUPAC Name]
6-[6-(5,7-Dihydroxy-4-oxo-4H-chromen-2-yl)-2,3-dihydroxyphenyl]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-chromen-4-one [ACD/IUPAC Name]
6-[6-(5,7-Dihydroxy-4-oxo-4H-chromén-2-yl)-2,3-dihydroxyphényl]-2-(3,4-dihydroxyphényl)-5,7-dihydroxy-4H-chromén-4-one [French] [ACD/IUPAC Name]
116383-34-7 [RN]
Dicranolomin

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

NCI60_029787 [DBID]
NSC683133 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.8±0.1 g/cm3
Boiling Point: 1018.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 153.9±3.0 kJ/mol
Flash Point: 341.8±27.8 °C
Index of Refraction: 1.834
Molar Refractivity: 141.8±0.3 cm3
#H bond acceptors: 12
#H bond donors: 8
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 3
ACD/LogP: 3.43
ACD/LogD (pH 5.5): 2.83
ACD/BCF (pH 5.5): 62.55
ACD/KOC (pH 5.5): 477.21
ACD/LogD (pH 7.4): -0.61
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 214 Å2
Polarizability: 56.2±0.5 10-24cm3
Surface Tension: 109.0±3.0 dyne/cm
Molar Volume: 321.8±3.0 cm3

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