ChemSpider 2D Image | 2',3,4,4',5',6-Hexabromo-2-biphenylol | C12H4Br6O

2',3,4,4',5',6-Hexabromo-2-biphenylol

  • Molecular FormulaC12H4Br6O
  • Average mass643.584 Da
  • Monoisotopic mass637.536194 Da
  • ChemSpider ID163481

More details:






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

[1,1'-Biphenyl]-2-ol, 2',3,4,4',5',6-hexabromo- [ACD/Index Name]
2',3,4,4',5',6-Hexabrom-2-biphenylol [German] [ACD/IUPAC Name]
2',3,4,4',5',6-Hexabromo-2-biphenylol [ACD/IUPAC Name]
2',3,4,4',5',6-Hexabromo-2-biphénylol [French] [ACD/IUPAC Name]
2',3,4,4',5',6-hexabromobiphenyl-2-ol
68794-95-6 [RN]
2,3,5-tribromo-6-(2,4,5-tribromophenyl)phenol
80267-23-8 [RN]

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

16R7N5VD49 [DBID]
UNII:16R7N5VD49 [DBID]
UNII-16R7N5VD49 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 2.6±0.1 g/cm3
Boiling Point: 465.7±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.5±3.0 kJ/mol
Flash Point: 235.4±27.3 °C
Index of Refraction: 1.720
Molar Refractivity: 98.9±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 2
ACD/LogP: 7.91
ACD/LogD (pH 5.5): 7.19
ACD/BCF (pH 5.5): 137295.77
ACD/KOC (pH 5.5): 127378.84
ACD/LogD (pH 7.4): 5.54
ACD/BCF (pH 7.4): 3080.81
ACD/KOC (pH 7.4): 2858.28
Polar Surface Area: 20 Å2
Polarizability: 39.2±0.5 10-24cm3
Surface Tension: 60.7±3.0 dyne/cm
Molar Volume: 250.3±3.0 cm3

Click to predict properties on the Chemicalize site






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