1,2,3,7,8-Pentabromodibenzofuran
TL;DR: 1,2,3,7,8-Pentabromodibenzofuran (CAS 107555-93-1) is a chemical compound with molecular formula C12H3Br5O and molecular weight 557.6101 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2,3,7,8-pentabromodibenzofuran
Also Known As: 1,2,3,7,8-Pentabromodibenzofuran, 1,2,3,7,8-PeBDF, Dibenzofuran, 1,2,3,7,8-pentabromo-, Dibenzofuran,1,2,3,7,8-pentabromo-, 1,2,3,7,8-pentabromo-dibenzofuran
Technical Specifications
| Molecular Formula | C12H3Br5O |
| Molecular Weight | 557.6101 g/mol |
| XLogP | 7.1 |
| Topological Polar Surface Area (TPSA) | 13.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 561.60596 Da |
| Heavy Atoms | 18 |
| Complexity | 328.0 |
| SMILES | C1=C2C(=CC(=C1Br)Br)OC3=CC(=C(C(=C23)Br)Br)Br |
| InChIKey | QMKPILUKNSMQTD-UHFFFAOYSA-N |
Chemical Property Profile of 1,2,3,7,8-Pentabromodibenzofuran
Property Insights of 1,2,3,7,8-Pentabromodibenzofuran
The XLogP value of 7.1 indicates that 1,2,3,7,8-Pentabromodibenzofuran is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 13.1 Ų, 1,2,3,7,8-Pentabromodibenzofuran exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3,7,8-Pentabromodibenzofuran 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 1,2,3,7,8-Pentabromodibenzofuran?
The CAS number of 1,2,3,7,8-Pentabromodibenzofuran is 107555-93-1.
What is the molecular formula of 1,2,3,7,8-Pentabromodibenzofuran?
The molecular formula of 1,2,3,7,8-Pentabromodibenzofuran is C12H3Br5O.
What is the molecular weight of 1,2,3,7,8-Pentabromodibenzofuran?
The molecular weight of 1,2,3,7,8-Pentabromodibenzofuran is 557.6101 g/mol.
Where can I buy 1,2,3,7,8-Pentabromodibenzofuran?
You can request a quote for 1,2,3,7,8-Pentabromodibenzofuran directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,2,3,7,8-Pentabromodibenzofuran?
Yes, CoreyChem provides custom synthesis services for 1,2,3,7,8-Pentabromodibenzofuran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.