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ChemSpider 2D Image | 2,2',3,4',6'-PENTABROMODIPHENYL ETHER | C12H5Br5O


  • Molecular FormulaC12H5Br5O
  • Average mass564.688 Da
  • Monoisotopic mass559.625671 Da
  • ChemSpider ID35766133

More details:

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

1,3,5-Tribrom-2-(2,3-dibromphenoxy)benzol [German] [ACD/IUPAC Name]
1,3,5-Tribromo-2-(2,3-dibromophenoxy)benzene [ACD/IUPAC Name]
1,3,5-Tribromo-2-(2,3-dibromophénoxy)benzène [French] [ACD/IUPAC Name]
38463-82-0 [RN]
Benzene, 1,3,5-tribromo-2-(2,3-dibromophenoxy)- [ACD/Index Name]

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

17A33785AI [DBID]
UNII:17A33785AI [DBID]

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

Density: 2.3±0.1 g/cm3
Boiling Point: 422.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 65.0±3.0 kJ/mol
Flash Point: 174.8±27.2 °C
Index of Refraction: 1.681
Molar Refractivity: 91.1±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 2
ACD/LogP: 7.95
ACD/LogD (pH 5.5): 7.13
ACD/BCF (pH 5.5): 153487.09
ACD/KOC (pH 5.5): 179377.30
ACD/LogD (pH 7.4): 7.13
ACD/BCF (pH 7.4): 153487.09
ACD/KOC (pH 7.4): 179377.30
Polar Surface Area: 9 Å2
Polarizability: 36.1±0.5 10-24cm3
Surface Tension: 53.3±3.0 dyne/cm
Molar Volume: 240.9±3.0 cm3

Click to predict properties on the Chemicalize site