ChemSpider 2D Image | 2,3,4,4',5,6-HEXABROMODIPHENYL ETHER | C12H4Br6O

2,3,4,4',5,6-HEXABROMODIPHENYL ETHER

  • Molecular FormulaC12H4Br6O
  • Average mass643.584 Da
  • Monoisotopic mass637.536194 Da
  • ChemSpider ID10239074

More details:

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

1,2,3,4,5-Pentabrom-6-(4-bromphenoxy)benzol [German] [ACD/IUPAC Name]
1,2,3,4,5-Pentabromo-6-(4-bromophenoxy)benzene [ACD/IUPAC Name]
1,2,3,4,5-Pentabromo-6-(4-bromophénoxy)benzène [French] [ACD/IUPAC Name]
189084-58-0 [RN]
2,3,4,4',5,6-HEXABROMODIPHENYL ETHER
Benzene, 1,2,3,4,5-pentabromo-6-(4-bromophenoxy)- [ACD/Index Name]
2,3,4,45,6-HEXABROMODIPHENYL ETHER

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

0612NYE44G [DBID]
UNII:0612NYE44G [DBID]

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

Density: 2.5±0.1 g/cm3
Boiling Point: 467.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.2±3.0 kJ/mol
Flash Point: 195.0±27.2 °C
Index of Refraction: 1.695
Molar Refractivity: 98.8±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 2
ACD/LogP: 8.62
ACD/LogD (pH 5.5): 7.67
ACD/BCF (pH 5.5): 395115.47
ACD/KOC (pH 5.5): 352945.81
ACD/LogD (pH 7.4): 7.67
ACD/BCF (pH 7.4): 395115.47
ACD/KOC (pH 7.4): 352945.81
Polar Surface Area: 9 Å2
Polarizability: 39.2±0.5 10-24cm3
Surface Tension: 55.4±3.0 dyne/cm
Molar Volume: 257.1±3.0 cm3

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