2,2',3,3',4,5',6,6'-Octabromobiphenyl

Base Information

• Chemical Name: 2,2',3,3',4,5',6,6'-Octabromobiphenyl
• CAS No.: 119264-60-7
• Molecular Formula: C12H2Br8
• Molecular Weight: 777.36
• UNII: 5853DG0C6W
• DSSTox Substance ID: DTXSID20152373
• Wikidata: Q27261556
• Mol file: 119264-60-7.mol

Synonyms:119264-60-7;2,2',3,3',4,5',6,6'-Octabromobiphenyl;1,2,3,5-tetrabromo-4-(2,3,5,6-tetrabromophenyl)benzene;5853DG0C6W;1,1'-Biphenyl, 2,2',3,3',4,5',6,6'-octabromo-;UNII-5853DG0C6W;2,2',3,3',4,5',6,6'-octabromo-1,1'-biphenyl;DTXSID20152373;Q27261556

Chemical Property of 2,2',3,3',4,5',6,6'-Octabromobiphenyl

Chemical Property:

• Vapor Pressure: 4.56E-10mmHg at 25°C
• Refractive Index: 1.72
• Boiling Point: 511.4 °C at 760 mmHg
• Flash Point: 253 °C
• PSA: 0.00000
• Density: 2.763 g/cm³
• LogP: 9.45360
• XLogP3: 9.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 785.35415
• Heavy Atom Count: 20
• Complexity: 325

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C(=C(C(=C1Br)Br)Br)C2=C(C(=CC(=C2Br)Br)Br)Br)Br
• Uses: 2,2’3,3’4,5’,6,6’-Octabromo-1,1’-biphenyl is a polybrominated biphenyls (PBB), used as flame retardants in plastics and textiles industries. It is also used in an assay for the determination of polybrominated biphenols in human milk.