Bde 47
TL;DR: Bde 47 (CAS 5436-43-1) is a chemical compound with molecular formula C12H6Br4O and molecular weight 481.7152 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,4-dibromo-1-(2,4-dibromophenoxy)benzene
Also Known As: 2,2',4,4'-Tetrabromodiphenyl ether, PBDE 47, 4,4'-Oxybis(1,3-dibromobenzene), DIBROMOPHENYL ETHER, TBDP-ether
Application Areas
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H6Br4O |
| Molecular Weight | 481.7152 g/mol |
| XLogP | 6.2 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 485.71112 Da |
| Heavy Atoms | 17 |
| Complexity | 227.0 |
| Melting Point | 82 - 82.5 °C |
| SMILES | C1=CC(=C(C=C1Br)Br)OC2=C(C=C(C=C2)Br)Br |
| InChIKey | XYBSIYMGXVUVGY-UHFFFAOYSA-N |
Chemical Property Profile of Bde 47
Property Insights of Bde 47
The XLogP value of 6.2 indicates that Bde 47 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, Bde 47 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bde 47 has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Bde 47?
The CAS number of Bde 47 is 5436-43-1.
What is the molecular formula of Bde 47?
The molecular formula of Bde 47 is C12H6Br4O.
What is the molecular weight of Bde 47?
The molecular weight of Bde 47 is 481.7152 g/mol.
Where can I buy Bde 47?
You can request a quote for Bde 47 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Bde 47?
Yes, CoreyChem provides custom synthesis services for Bde 47 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.