2-Bromo-1,3,6,8-tetrachlorooxanthrene
TL;DR: 2-Bromo-1,3,6,8-tetrachlorooxanthrene (CAS 122418-87-5) is a chemical compound with molecular formula C12H3BrCl4O2 and molecular weight 397.80704 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-bromo-1,3,6,8-tetrachlorodibenzo-p-dioxin
Also Known As: 2-Bromo-1,3,6,8-tetrachlorooxanthrene, 2-bromo-1,3,6,8-tetrachloro-dibenzo-p-dioxin, 2-bromo-1,3,6,8-tetrachlorodibenzo-p-dioxin
Technical Specifications
| Molecular Formula | C12H3BrCl4O2 |
| Molecular Weight | 397.80704 g/mol |
| XLogP | 6.6 |
| Topological Polar Surface Area (TPSA) | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 397.80704 Da |
| Heavy Atoms | 19 |
| Complexity | 348.0 |
| SMILES | C1=C(C=C(C2=C1OC3=C(C(=C(C=C3O2)Cl)Br)Cl)Cl)Cl |
| InChIKey | ZYARLMQXDLGDGE-UHFFFAOYSA-N |
Chemical Property Profile of 2-Bromo-1,3,6,8-tetrachlorooxanthrene
Property Insights of 2-Bromo-1,3,6,8-tetrachlorooxanthrene
The XLogP value of 6.6 indicates that 2-Bromo-1,3,6,8-tetrachlorooxanthrene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 2-Bromo-1,3,6,8-tetrachlorooxanthrene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromo-1,3,6,8-tetrachlorooxanthrene 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 2-Bromo-1,3,6,8-tetrachlorooxanthrene?
The CAS number of 2-Bromo-1,3,6,8-tetrachlorooxanthrene is 122418-87-5.
What is the molecular formula of 2-Bromo-1,3,6,8-tetrachlorooxanthrene?
The molecular formula of 2-Bromo-1,3,6,8-tetrachlorooxanthrene is C12H3BrCl4O2.
What is the molecular weight of 2-Bromo-1,3,6,8-tetrachlorooxanthrene?
The molecular weight of 2-Bromo-1,3,6,8-tetrachlorooxanthrene is 397.80704 g/mol.
Where can I buy 2-Bromo-1,3,6,8-tetrachlorooxanthrene?
You can request a quote for 2-Bromo-1,3,6,8-tetrachlorooxanthrene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Bromo-1,3,6,8-tetrachlorooxanthrene?
Yes, CoreyChem provides custom synthesis services for 2-Bromo-1,3,6,8-tetrachlorooxanthrene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.