2,2',4,4',6,6'-Hexachlorobiphenyl
TL;DR: 2,2',4,4',6,6'-Hexachlorobiphenyl (CAS 33979-03-2) is a chemical compound with molecular formula C12H4Cl6 and molecular weight 357.84 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,5-trichloro-2-(2,4,6-trichlorophenyl)benzene
Also Known As: 2,2',4,4',6,6'-HEXACHLOROBIPHENYL, PCB 155, 2,2',4,4',6,6'-Hexachloro-1,1'-biphenyl, 2,2',4,4',6,6'-Hexachlorodiphenyl, 2,4,6,2',4',6'-Hexachlorobiphenyl
| Molecular Formula | C12H4Cl6 |
|---|---|
| Molecular Weight | 357.84 g/mol |
| LogP | 7.3 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 359.84146 |
| Heavy Atoms | 18 |
| Complexity | 234.0 |
Chemical Identifiers
| CAS Number | 33979-03-2 |
|---|---|
| SMILES | C1=C(C=C(C(=C1Cl)C2=C(C=C(C=C2Cl)Cl)Cl)Cl)Cl |
| InChIKey | ICOAEPDGFWLUTI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2',4,4',6,6'-Hexachlorobiphenyl (CAS 33979-03-2), with molecular formula C12H4Cl6 and molecular weight 357.84 g/mol. IUPAC: 1,3,5-trichloro-2-(2,4,6-trichlorophenyl)benzene.
Chemical Property Profile of 2,2',4,4',6,6'-Hexachlorobiphenyl
Property Insights of 2,2',4,4',6,6'-Hexachlorobiphenyl
The XLogP value of 7.3 indicates that 2,2',4,4',6,6'-Hexachlorobiphenyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2,2',4,4',6,6'-Hexachlorobiphenyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2',4,4',6,6'-Hexachlorobiphenyl has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,2',4,4',6,6'-Hexachlorobiphenyl?
The CAS number of 2,2',4,4',6,6'-Hexachlorobiphenyl is 33979-03-2.
What is the molecular formula of 2,2',4,4',6,6'-Hexachlorobiphenyl?
The molecular formula of 2,2',4,4',6,6'-Hexachlorobiphenyl is C12H4Cl6.
What is the molecular weight of 2,2',4,4',6,6'-Hexachlorobiphenyl?
The molecular weight of 2,2',4,4',6,6'-Hexachlorobiphenyl is 357.84 g/mol.
Where can I buy 2,2',4,4',6,6'-Hexachlorobiphenyl?
You can request a quote for 2,2',4,4',6,6'-Hexachlorobiphenyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2',4,4',6,6'-Hexachlorobiphenyl?
Yes, KEHONG BIO provides custom synthesis services for 2,2',4,4',6,6'-Hexachlorobiphenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.