ChemSpider 2D Image | 2,2',3,4-TETRABROMODIPHENYL ETHER | C12H6Br4O

2,2',3,4-TETRABROMODIPHENYL ETHER

  • Molecular FormulaC12H6Br4O
  • Average mass485.791 Da
  • Monoisotopic mass481.715179 Da
  • ChemSpider ID52083732

More details:

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

1,2,3-Tribrom-4-(2-bromphenoxy)benzol [German] [ACD/IUPAC Name]
1,2,3-Tribromo-4-(2-bromophenoxy)benzene [ACD/IUPAC Name]
1,2,3-Tribromo-4-(2-bromophénoxy)benzène [French] [ACD/IUPAC Name]
2,2',3,4-TETRABROMODIPHENYL ETHER
337513-68-5 [RN]
Benzene, 1,2,3-tribromo-4-(2-bromophenoxy)- [ACD/Index Name]

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

N4SSS3657O [DBID]
UNII:N4SSS3657O [DBID]

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

Density: 2.2±0.1 g/cm3
Boiling Point: 404.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.0±3.0 kJ/mol
Flash Point: 166.7±27.2 °C
Index of Refraction: 1.665
Molar Refractivity: 83.5±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 7.17
ACD/LogD (pH 5.5): 6.59
ACD/BCF (pH 5.5): 59976.06
ACD/KOC (pH 5.5): 91549.93
ACD/LogD (pH 7.4): 6.59
ACD/BCF (pH 7.4): 59976.06
ACD/KOC (pH 7.4): 91549.93
Polar Surface Area: 9 Å2
Polarizability: 33.1±0.5 10-24cm3
Surface Tension: 50.9±3.0 dyne/cm
Molar Volume: 224.8±3.0 cm3

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