2,2',3,4,5,5'-Hexabromobiphenyl
TL;DR: 2,2',3,4,5,5'-Hexabromobiphenyl (CAS 120991-47-1) is a chemical compound with molecular formula C12H4Br6 and molecular weight 621.5413 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2,3,4-tetrabromo-5-(2,5-dibromophenyl)benzene
Also Known As: 2,2',3,4,5,5'-hexabromobiphenyl, 1,2,3,4-tetrabromo-5-(2,5-dibromophenyl)benzene, PBB 141, 2,23,4,5,5HexabroMobiphenyl, 1,1'-Biphenyl, 2,2',3,4,5,5'-hexabromo-
Technical Specifications
| Molecular Formula | C12H4Br6 |
| Molecular Weight | 621.5413 g/mol |
| XLogP | 7.8 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 621.5413 Da |
| Heavy Atoms | 18 |
| Complexity | 286.0 |
| SMILES | C1=CC(=C(C=C1Br)C2=CC(=C(C(=C2Br)Br)Br)Br)Br |
| InChIKey | RBEVZFMPNHHLPP-UHFFFAOYSA-N |
Chemical Property Profile of 2,2',3,4,5,5'-Hexabromobiphenyl
Property Insights of 2,2',3,4,5,5'-Hexabromobiphenyl
The XLogP value of 7.8 indicates that 2,2',3,4,5,5'-Hexabromobiphenyl 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',3,4,5,5'-Hexabromobiphenyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2',3,4,5,5'-Hexabromobiphenyl has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 2,2',3,4,5,5'-Hexabromobiphenyl?
The CAS number of 2,2',3,4,5,5'-Hexabromobiphenyl is 120991-47-1.
What is the molecular formula of 2,2',3,4,5,5'-Hexabromobiphenyl?
The molecular formula of 2,2',3,4,5,5'-Hexabromobiphenyl is C12H4Br6.
What is the molecular weight of 2,2',3,4,5,5'-Hexabromobiphenyl?
The molecular weight of 2,2',3,4,5,5'-Hexabromobiphenyl is 621.5413 g/mol.
Where can I buy 2,2',3,4,5,5'-Hexabromobiphenyl?
You can request a quote for 2,2',3,4,5,5'-Hexabromobiphenyl directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,2',3,4,5,5'-Hexabromobiphenyl?
Yes, CoreyChem provides custom synthesis services for 2,2',3,4,5,5'-Hexabromobiphenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.