ChemSpider 2D Image | 3-(Dibromomethyl)-1,8-dimethoxy-9,10-anthraquinone | C17H12Br2O4

3-(Dibromomethyl)-1,8-dimethoxy-9,10-anthraquinone

  • Molecular FormulaC17H12Br2O4
  • Average mass440.083 Da
  • Monoisotopic mass437.910217 Da
  • ChemSpider ID23136601

More details:

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

121210-60-4 [RN]
3-(Dibrommethyl)-1,8-dimethoxy-9,10-anthrachinon [German] [ACD/IUPAC Name]
3-(Dibromomethyl)-1,8-dimethoxy-9,10-anthracenedione
3-(Dibromomethyl)-1,8-dimethoxy-9,10-anthraquinone [ACD/IUPAC Name]
3-(Dibromométhyl)-1,8-diméthoxy-9,10-anthraquinone [French] [ACD/IUPAC Name]
9,10-Anthracenedione, 3-(dibromomethyl)-1,8-dimethoxy- [ACD/Index Name]
3-Dibromomethyl-1,8-dimethoxy-anthraquinone
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL289940/

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

Density: 1.8±0.1 g/cm3
Boiling Point: 577.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.5±3.0 kJ/mol
Flash Point: 303.1±30.1 °C
Index of Refraction: 1.659
Molar Refractivity: 92.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.62
ACD/LogD (pH 5.5): 4.42
ACD/BCF (pH 5.5): 1340.47
ACD/KOC (pH 5.5): 6026.84
ACD/LogD (pH 7.4): 4.42
ACD/BCF (pH 7.4): 1340.47
ACD/KOC (pH 7.4): 6026.84
Polar Surface Area: 53 Å2
Polarizability: 36.6±0.5 10-24cm3
Surface Tension: 58.9±3.0 dyne/cm
Molar Volume: 250.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement