2,2',4,5-Tetrachlorobiphenyl

Base Information

• Chemical Name: 2,2',4,5-Tetrachlorobiphenyl
• CAS No.: 70362-47-9
• Molecular Formula: C12H6Cl4
• Molecular Weight: 291.992
• UNII: 3287671514
• DSSTox Substance ID: DTXSID6074207
• Nikkaji Number: J209.081C
• Wikidata: Q27115902
• Metabolomics Workbench ID: 54935
• ChEMBL ID: CHEMBL1797285
• Mol file: 70362-47-9.mol

Synonyms:2,2',4,5-tetrachlorobiphenyl;70362-47-9;2,2',4,5-tetrachloro-1,1'-biphenyl;PCB 48;1,2,4-trichloro-5-(2-chlorophenyl)benzene;1,1'-Biphenyl,2,2',4,5-tetrachloro-;1,1'-Biphenyl, 2,2',4,5-tetrachloro-;2,2',4,5-tetrachlorodiphenyl;CHEBI:34205;UNII-3287671514;PCB 48 (2,2',4,5-Tetrachlorobiphenyl);PCB No. 48;PCB-48;SCHEMBL4458304;CHEMBL1797285;DTXSID6074207;2,2/',4,5-Tetrachlorobiphenyl;PCB No. 48 10 microg/mL in Isooctane;1,1'-Biphenyl, 2,2',4,5-tetrachloro;3-AMINO-3-CYCLOPENTYL-PROPIONICACIDAMIDE;Q27115902

Chemical Property of 2,2',4,5-Tetrachlorobiphenyl

Chemical Property:

• Melting Point: 65.9°C
• Refractive Index: 1.6120 (rough estimate)
• Boiling Point: 344.8 °C at 760 mmHg
• Flash Point: 161.9 °C
• PSA: 0.00000
• Density: 1.441g/cm³
• LogP: 5.96720
• Water Solubility.: 16.44ug/L(25 oC)
• XLogP3: 6.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 291.919411
• Heavy Atom Count: 16
• Complexity: 233

Purity/Quality:

98%Min ^*data from raw 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)C2=CC(=C(C=C2Cl)Cl)Cl)Cl
• Uses: 2,2'',4,5''-Tetrachlorobiphenyl is a polychlorinated biphenyl (PCB) congeners.

Technology Process of 2,2',4,5-Tetrachlorobiphenyl

There total 1 articles about 2,2',4,5-Tetrachlorobiphenyl which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

2,2',4,4',5,5'-Hexachlorobiphenyl (35065-27-1,51908-10-2) → 2-chloro-1,1'-biphenyl (2051-60-7,108321-69-3) + 2,4,5-trichlorobiphenyl (15862-07-4) + PCB 7 (33284-50-3) + 2,4,5,2'-tetrachlorobiphenyl (70362-47-9)

Guidance literature:

With potassium Sodium; In cyclohexane; at 20 ℃; for 0.25h; Product distribution;

DOI:10.1016/S0045-6535(99)00557-3

upstream raw materials:

2,2',4,4',5,5'-Hexachlorobiphenyl

Refernces