ChemSpider 2D Image | 5-OH-BDE 47 | C12H6Br4O2

5-OH-BDE 47

  • Molecular FormulaC12H6Br4O2
  • Average mass501.791 Da
  • Monoisotopic mass497.710114 Da
  • ChemSpider ID9905528

More details:

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

2,4-Dibrom-5-(2,4-dibromphenoxy)phenol [German] [ACD/IUPAC Name]
2,4-Dibromo-5-(2,4-dibromophenoxy)phenol [ACD/IUPAC Name]
2,4-Dibromo-5-(2,4-dibromophénoxy)phénol [French] [ACD/IUPAC Name]
5-OH-BDE 47
602326-30-7 [RN]
Phenol, 2,4-dibromo-5-(2,4-dibromophenoxy)- [ACD/Index Name]

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

Density: 2.2±0.1 g/cm3
Boiling Point: 415.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.5±3.0 kJ/mol
Flash Point: 205.1±28.7 °C
Index of Refraction: 1.690
Molar Refractivity: 85.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 2
ACD/LogP: 7.28
ACD/LogD (pH 5.5): 6.60
ACD/BCF (pH 5.5): 60719.48
ACD/KOC (pH 5.5): 91732.34
ACD/LogD (pH 7.4): 6.14
ACD/BCF (pH 7.4): 21237.00
ACD/KOC (pH 7.4): 32083.93
Polar Surface Area: 29 Å2
Polarizability: 33.8±0.5 10-24cm3
Surface Tension: 57.8±3.0 dyne/cm
Molar Volume: 223.2±3.0 cm3

Click to predict properties on the Chemicalize site


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