1,2,3,7,8-Pentabromodibenzo-P-dioxin
TL;DR: 1,2,3,7,8-Pentabromodibenzo-P-dioxin (CAS 109333-34-8) is a chemical compound with molecular formula C12H3Br5O2 and molecular weight 573.605 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2,3,7,8-pentabromodibenzo-p-dioxin
Also Known As: 1,2,3,7,8-PENTABROMODIBENZO-P-DIOXIN, 1,2,3,7,8-pentabromooxanthrene, 1,2,3,7,8-PeBDD, 1,2,3,7,8-pentabromo-dibenzo-p-dioxin, 2,3,4,7,8-Pentabromodibenzo-p-dioxin
Technical Specifications
| Molecular Formula | C12H3Br5O2 |
| Molecular Weight | 573.605 g/mol |
| XLogP | 6.5 |
| Topological Polar Surface Area (TPSA) | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 577.6009 Da |
| Heavy Atoms | 19 |
| Complexity | 344.0 |
| SMILES | C1=C2C(=CC(=C1Br)Br)OC3=C(C(=C(C=C3O2)Br)Br)Br |
| InChIKey | ZIFMQFDZODRVTG-UHFFFAOYSA-N |
Chemical Property Profile of 1,2,3,7,8-Pentabromodibenzo-P-dioxin
Property Insights of 1,2,3,7,8-Pentabromodibenzo-P-dioxin
The XLogP value of 6.5 indicates that 1,2,3,7,8-Pentabromodibenzo-P-dioxin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 1,2,3,7,8-Pentabromodibenzo-P-dioxin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3,7,8-Pentabromodibenzo-P-dioxin has 0 hydrogen bond donor(s) and 2 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-Pentabromodibenzo-P-dioxin?
The CAS number of 1,2,3,7,8-Pentabromodibenzo-P-dioxin is 109333-34-8.
What is the molecular formula of 1,2,3,7,8-Pentabromodibenzo-P-dioxin?
The molecular formula of 1,2,3,7,8-Pentabromodibenzo-P-dioxin is C12H3Br5O2.
What is the molecular weight of 1,2,3,7,8-Pentabromodibenzo-P-dioxin?
The molecular weight of 1,2,3,7,8-Pentabromodibenzo-P-dioxin is 573.605 g/mol.
Where can I buy 1,2,3,7,8-Pentabromodibenzo-P-dioxin?
You can request a quote for 1,2,3,7,8-Pentabromodibenzo-P-dioxin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,2,3,7,8-Pentabromodibenzo-P-dioxin?
Yes, CoreyChem provides custom synthesis services for 1,2,3,7,8-Pentabromodibenzo-P-dioxin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.