2,2',3,4,6,6'-Hexachlorobiphenyl

Base Information

• Chemical Name: 2,2',3,4,6,6'-Hexachlorobiphenyl
• CAS No.: 74472-40-5
• Molecular Formula: C12H4Cl6
• Molecular Weight: 360.88
• UNII: 237640M72H
• DSSTox Substance ID: DTXSID4074229
• Nikkaji Number: J151.534I
• Wikidata: Q27253720
• Mol file: 74472-40-5.mol

Synonyms:2,2',3,4,6,6'-Hexachlorobiphenyl;74472-40-5;PCB 145;UNII-237640M72H;1,1'-Biphenyl, 2,2',3,4,6,6'-hexachloro-;1,2,3,5-tetrachloro-4-(2,6-dichlorophenyl)benzene;237640M72H;DTXSID4074229;2,2',3,4,6,6'-Hexachloro-1,1'-biphenyl;1,1'-Biphenyl,2,2',3,4,6,6'-hexachloro-;SCHEMBL4448496;DTXCID9047679;JZFZCLFEPXCRCA-UHFFFAOYSA-N;PCB No. 145 10 microg/mL in Isooctane;A22628;Q27253720;2,2',3,4,6,6'-HexaCB

Chemical Property of 2,2',3,4,6,6'-Hexachlorobiphenyl

Chemical Property:

• Melting Point: 115.76°C (estimate)
• Refractive Index: 1.6270 (rough estimate)
• Boiling Point: 369.3 °C at 760 mmHg
• Flash Point: 173.3 °C
• PSA: 0.00000
• Density: 1.593 g/cm³
• LogP: 7.27400
• XLogP3: 6.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 359.841466
• Heavy Atom Count: 18
• Complexity: 276

Purity/Quality:

99% ^*data from raw suppliers

2,2',3,4,6,6'-HEXACHLOROBIPHENYL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC(=C(C(=C1)Cl)C2=C(C(=C(C=C2Cl)Cl)Cl)Cl)Cl
• Uses: 2,2'',3,4,6,6''-Hexachlorobiphenyl is a polychlorinated biphenyl (PCB) congeners.