ChemSpider 2D Image | (11bR)-4,8,10-Trihydroxy-11b-(4-hydroxyphenyl)-7-(4-oxo-2,5-cyclohexadien-1-ylidene)-7,11b-dihydro-2-oxadibenzo[cd,h]azulene-1,6-dione | C28H16O8

(11bR)-4,8,10-Trihydroxy-11b-(4-hydroxyphenyl)-7-(4-oxo-2,5-cyclohexadien-1-ylidene)-7,11b-dihydro-2-oxadibenzo[cd,h]azulene-1,6-dione

  • Molecular FormulaC28H16O8
  • Average mass480.422 Da
  • Monoisotopic mass480.084503 Da
  • ChemSpider ID75555134

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(11bR)-4,8,10-Trihydroxy-11b-(4-hydroxyphenyl)-7-(4-oxo-2,5-cyclohexadien-1-yliden)-7,11b-dihydro-2-oxadibenzo[cd,h]azulen-1,6-dion [German] [ACD/IUPAC Name]
(11bR)-4,8,10-Trihydroxy-11b-(4-hydroxyphenyl)-7-(4-oxo-2,5-cyclohexadien-1-ylidene)-7,11b-dihydro-2-oxadibenzo[cd,h]azulene-1,6-dione [ACD/IUPAC Name]
(11bR)-4,8,10-Trihydroxy-11b-(4-hydroxyphényl)-7-(4-oxo-2,5-cyclohexadién-1-ylidène)-7,11b-dihydro-2-oxadibenzo[cd,h]azulène-1,6-dione [French] [ACD/IUPAC Name]
Benzo[6,7]cyclohepta[1,2,3-cd]benzofuran-1,6-dione, 7,11b-dihydro-4,8,10-trihydroxy-11b-(4-hydroxyphenyl)-7-(4-oxo-2,5-cyclohexadien-1-ylidene)-, (11bR)- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 846.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 127.2±3.0 kJ/mol
Flash Point: 293.6±27.8 °C
Index of Refraction: 1.814
Molar Refractivity: 124.2±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.51
ACD/LogD (pH 5.5): 2.26
ACD/BCF (pH 5.5): 30.87
ACD/KOC (pH 5.5): 404.01
ACD/LogD (pH 7.4): 1.94
ACD/BCF (pH 7.4): 14.68
ACD/KOC (pH 7.4): 192.15
Polar Surface Area: 141 Å2
Polarizability: 49.2±0.5 10-24cm3
Surface Tension: 99.7±3.0 dyne/cm
Molar Volume: 286.9±3.0 cm3

Click to predict properties on the Chemicalize site


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