ChemSpider 2D Image | 3,4',5-TRIBROMODIPHENYL ETHER | C12H7Br3O

3,4',5-TRIBROMODIPHENYL ETHER

  • Molecular FormulaC12H7Br3O
  • Average mass406.895 Da
  • Monoisotopic mass403.804688 Da
  • ChemSpider ID28549045

More details:

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

1,3-Dibrom-5-(4-bromphenoxy)benzol [German] [ACD/IUPAC Name]
1,3-Dibromo-5-(4-bromophenoxy)benzene [ACD/IUPAC Name]
1,3-Dibromo-5-(4-bromophénoxy)benzène [French] [ACD/IUPAC Name]
3,4',5-TRIBROMODIPHENYL ETHER
407606-57-9 [RN]
Benzene, 1,3-dibromo-5-(4-bromophenoxy)- [ACD/Index Name]

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

HD5CNW367A [DBID]
UNII:HD5CNW367A [DBID]

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

Density: 2.0±0.1 g/cm3
Boiling Point: 386.1±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.0±3.0 kJ/mol
Flash Point: 158.7±25.0 °C
Index of Refraction: 1.647
Molar Refractivity: 75.8±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 6.87
ACD/LogD (pH 5.5): 5.94
ACD/BCF (pH 5.5): 19119.06
ACD/KOC (pH 5.5): 40388.74
ACD/LogD (pH 7.4): 5.94
ACD/BCF (pH 7.4): 19119.06
ACD/KOC (pH 7.4): 40388.74
Polar Surface Area: 9 Å2
Polarizability: 30.0±0.5 10-24cm3
Surface Tension: 48.3±3.0 dyne/cm
Molar Volume: 208.6±3.0 cm3

Click to predict properties on the Chemicalize site


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