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

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

  • Molecular FormulaC12H4Br6O
  • Average mass643.584 Da
  • Monoisotopic mass637.536194 Da
  • ChemSpider ID35517738

More details:

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

1,2,4-Tribrom-3-(2,3,4-tribromphenoxy)benzol [German] [ACD/IUPAC Name]
1,2,4-Tribromo-3-(2,3,4-tribromophenoxy)benzene [ACD/IUPAC Name]
1,2,4-Tribromo-3-(2,3,4-tribromophénoxy)benzène [French] [ACD/IUPAC Name]
2,2',3,3',4,6'-HEXABROMODIPHENYL ETHER
446254-90-6 [RN]
Benzene, 1,2,4-tribromo-3-(2,3,4-tribromophenoxy)- [ACD/Index Name]
2,2',3,4,5',6'-Hexabromodiphenyl ether

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

52YSX4G22I [DBID]
UNII:52YSX4G22I [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: 464.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.8±3.0 kJ/mol
Flash Point: 193.6±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: 8.66
ACD/LogD (pH 5.5): 7.82
ACD/BCF (pH 5.5): 511714.00
ACD/KOC (pH 5.5): 424710.75
ACD/LogD (pH 7.4): 7.82
ACD/BCF (pH 7.4): 511714.00
ACD/KOC (pH 7.4): 424710.75
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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