ChemSpider 2D Image | 2-Methoxy-2-oxoethyl 1-amino-4-bromo-9,10-dioxo-9,10-dihydro-2-anthracenecarboxylate | C18H12BrNO6

2-Methoxy-2-oxoethyl 1-amino-4-bromo-9,10-dioxo-9,10-dihydro-2-anthracenecarboxylate

  • Molecular FormulaC18H12BrNO6
  • Average mass418.195 Da
  • Monoisotopic mass416.984802 Da
  • ChemSpider ID21971877

More details:

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

1-Amino-4-bromo-9,10-dioxo-9,10-dihydro-2-anthracènecarboxylate de 2-méthoxy-2-oxoéthyle [French] [ACD/IUPAC Name]
2-Anthracenecarboxylic acid, 1-amino-4-bromo-9,10-dihydro-9,10-dioxo-, 2-methoxy-2-oxoethyl ester [ACD/Index Name]
2-Methoxy-2-oxoethyl 1-amino-4-bromo-9,10-dioxo-9,10-dihydro-2-anthracenecarboxylate [ACD/IUPAC Name]
2-Methoxy-2-oxoethyl-1-amino-4-brom-9,10-dioxo-9,10-dihydro-2-anthracencarboxylat [German] [ACD/IUPAC 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: 628.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.0±3.0 kJ/mol
Flash Point: 333.9±31.5 °C
Index of Refraction: 1.664
Molar Refractivity: 93.4±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.12
ACD/LogD (pH 5.5): 4.08
ACD/BCF (pH 5.5): 743.62
ACD/KOC (pH 5.5): 3952.88
ACD/LogD (pH 7.4): 4.08
ACD/BCF (pH 7.4): 743.62
ACD/KOC (pH 7.4): 3952.88
Polar Surface Area: 113 Å2
Polarizability: 37.0±0.5 10-24cm3
Surface Tension: 68.0±3.0 dyne/cm
Molar Volume: 251.9±3.0 cm3

Click to predict properties on the Chemicalize site


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