2,2',4,4'-Tetrabromobiphenyl
TL;DR: 2,2',4,4'-Tetrabromobiphenyl (CAS 66115-57-9) is a chemical compound with molecular formula C12H6Br4 and molecular weight 465.72 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dibromo-1-(2,4-dibromophenyl)benzene
Also Known As: 2,4-dibromo-1-(2,4-dibromophenyl)benzene, 2,2',4,4'-Tetrabromobiphenyl, 2,4-dibromo-1- benzene, PBB No. 47, 2,4,2',4'-Tetrabrom-biphenyl
| Molecular Formula | C12H6Br4 |
|---|---|
| Molecular Weight | 465.72 g/mol |
| LogP | 6.5 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 465.7203 |
| Heavy Atoms | 16 |
| Complexity | 209.0 |
Chemical Identifiers
| CAS Number | 66115-57-9 |
|---|---|
| SMILES | C1=CC(=C(C=C1Br)Br)C2=C(C=C(C=C2)Br)Br |
| InChIKey | UBJWRBZIWNERQZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2',4,4'-Tetrabromobiphenyl (CAS 66115-57-9), with molecular formula C12H6Br4 and molecular weight 465.72 g/mol. IUPAC: 2,4-dibromo-1-(2,4-dibromophenyl)benzene.
Chemical Property Profile of 2,2',4,4'-Tetrabromobiphenyl
Property Insights of 2,2',4,4'-Tetrabromobiphenyl
The XLogP value of 6.5 indicates that 2,2',4,4'-Tetrabromobiphenyl 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'-Tetrabromobiphenyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2',4,4'-Tetrabromobiphenyl 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'-Tetrabromobiphenyl?
The CAS number of 2,2',4,4'-Tetrabromobiphenyl is 66115-57-9.
What is the molecular formula of 2,2',4,4'-Tetrabromobiphenyl?
The molecular formula of 2,2',4,4'-Tetrabromobiphenyl is C12H6Br4.
What is the molecular weight of 2,2',4,4'-Tetrabromobiphenyl?
The molecular weight of 2,2',4,4'-Tetrabromobiphenyl is 465.72 g/mol.
Where can I buy 2,2',4,4'-Tetrabromobiphenyl?
You can request a quote for 2,2',4,4'-Tetrabromobiphenyl 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'-Tetrabromobiphenyl?
Yes, KEHONG BIO provides custom synthesis services for 2,2',4,4'-Tetrabromobiphenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.