ChemSpider 2D Image | 2-[(2-Acetoxybenzoyl)oxy]ethyl 4,5-dihydroxy-9,10-dioxo-9,10-dihydro-2-anthracenecarboxylate | C26H18O10

2-[(2-Acetoxybenzoyl)oxy]ethyl 4,5-dihydroxy-9,10-dioxo-9,10-dihydro-2-anthracenecarboxylate

  • Molecular FormulaC26H18O10
  • Average mass490.415 Da
  • Monoisotopic mass490.089996 Da
  • ChemSpider ID28527842

More details:

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

2-[(2-Acetoxybenzoyl)oxy]ethyl 4,5-dihydroxy-9,10-dioxo-9,10-dihydro-2-anthracenecarboxylate [ACD/IUPAC Name]
2-[(2-Acetoxybenzoyl)oxy]ethyl-4,5-dihydroxy-9,10-dioxo-9,10-dihydro-2-anthracencarboxylat [German] [ACD/IUPAC Name]
2-Anthracenecarboxylic acid, 9,10-dihydro-4,5-dihydroxy-9,10-dioxo-, 2-[[2-(acetyloxy)benzoyl]oxy]ethyl ester [ACD/Index Name]
4,5-Dihydroxy-9,10-dioxo-9,10-dihydro-2-anthracènecarboxylate de 2-[(2-acétoxybenzoyl)oxy]éthyle [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 735.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 111.1±3.0 kJ/mol
Flash Point: 252.1±26.4 °C
Index of Refraction: 1.657
Molar Refractivity: 121.5±0.3 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 6.54
ACD/LogD (pH 5.5): 5.08
ACD/BCF (pH 5.5): 3672.14
ACD/KOC (pH 5.5): 10365.49
ACD/LogD (pH 7.4): 2.84
ACD/BCF (pH 7.4): 21.06
ACD/KOC (pH 7.4): 59.45
Polar Surface Area: 154 Å2
Polarizability: 48.2±0.5 10-24cm3
Surface Tension: 69.2±3.0 dyne/cm
Molar Volume: 330.2±3.0 cm3

Click to predict properties on the Chemicalize site


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