TL;DR: 2,3,3',4,4',5-Hexachlorobiphenyl (CAS 38380-08-4) is a chemical compound with molecular formula C12H4Cl6 and molecular weight 357.84442 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2,3,4-tetrachloro-5-(3,4-dichlorophenyl)benzene
Also Known As: 2,3,3',4,4',5-HEXACHLOROBIPHENYL, PCB 156, PCB No 156 solution, PCB No. 156, 3,4,2',3',4',5'-Hexachlorobiphenyl
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C12H4Cl6 |
| Molecular Weight | 357.84442 g/mol |
| XLogP | 7.6 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 359.84146 Da |
| Heavy Atoms | 18 |
| Complexity | 286.0 |
| SMILES | C1=CC(=C(C=C1C2=CC(=C(C(=C2Cl)Cl)Cl)Cl)Cl)Cl |
| InChIKey | LCXMEXLGMKFLQO-UHFFFAOYSA-N |
The XLogP value of 7.6 indicates that 2,3,3',4,4',5-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, 2,3,3',4,4',5-Hexachlorobiphenyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,3',4,4',5-Hexachlorobiphenyl has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2,3,3',4,4',5-Hexachlorobiphenyl is 38380-08-4.
The molecular formula of 2,3,3',4,4',5-Hexachlorobiphenyl is C12H4Cl6.
The molecular weight of 2,3,3',4,4',5-Hexachlorobiphenyl is 357.84442 g/mol.
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