1-Bromo-2,4,7,9-tetrachlorooxanthrene
TL;DR: 1-Bromo-2,4,7,9-tetrachlorooxanthrene (CAS 122418-86-4) is a chemical compound with molecular formula C12H3BrCl4O2 and molecular weight 397.81 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-2,4,7,9-tetrachlorodibenzo-p-dioxin
Also Known As: 1-Bromo-2,4,7,9-tetrachlorooxanthrene, 1-bromo-2,4,7,9-tetrachloro-dibenzo-p-dioxin, 1-bromo-2,4,7,9-tetrachlorodibenzo-p-dioxin, RefChem:228295
| Molecular Formula | C12H3BrCl4O2 |
|---|---|
| Molecular Weight | 397.81 g/mol |
| LogP | 7.1 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 397.80704 |
| Heavy Atoms | 19 |
| Complexity | 348.0 |
Chemical Identifiers
| CAS Number | 122418-86-4 |
|---|---|
| SMILES | C1=C(C=C(C2=C1OC3=C(O2)C(=C(C=C3Cl)Cl)Br)Cl)Cl |
| InChIKey | MBRQDMQYVZRDBA-UHFFFAOYSA-N |
Product Overview
1-Bromo-2,4,7,9-tetrachlorooxanthrene (CAS 122418-86-4), with molecular formula C12H3BrCl4O2 and molecular weight 397.81 g/mol. IUPAC: 1-bromo-2,4,7,9-tetrachlorodibenzo-p-dioxin.
Chemical Property Profile of 1-Bromo-2,4,7,9-tetrachlorooxanthrene
Property Insights of 1-Bromo-2,4,7,9-tetrachlorooxanthrene
The XLogP value of 7.1 indicates that 1-Bromo-2,4,7,9-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, 1-Bromo-2,4,7,9-tetrachlorooxanthrene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Bromo-2,4,7,9-tetrachlorooxanthrene has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Bromo-2,4,7,9-tetrachlorooxanthrene?
The CAS number of 1-Bromo-2,4,7,9-tetrachlorooxanthrene is 122418-86-4.
What is the molecular formula of 1-Bromo-2,4,7,9-tetrachlorooxanthrene?
The molecular formula of 1-Bromo-2,4,7,9-tetrachlorooxanthrene is C12H3BrCl4O2.
What is the molecular weight of 1-Bromo-2,4,7,9-tetrachlorooxanthrene?
The molecular weight of 1-Bromo-2,4,7,9-tetrachlorooxanthrene is 397.81 g/mol.
Where can I buy 1-Bromo-2,4,7,9-tetrachlorooxanthrene?
You can request a quote for 1-Bromo-2,4,7,9-tetrachlorooxanthrene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Bromo-2,4,7,9-tetrachlorooxanthrene?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromo-2,4,7,9-tetrachlorooxanthrene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.