2,4,4',5-Tetrachlorodiphenyl ether
TL;DR: 2,4,4',5-Tetrachlorodiphenyl ether (CAS 61328-45-8) is a chemical compound with molecular formula C12H6Cl4O and molecular weight 305.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,4-trichloro-5-(4-chlorophenoxy)benzene
Also Known As: 2,4,4',5-TETRACHLORODIPHENYL ETHER, 1,2,4-trichloro-5-(4-chlorophenoxy)benzene, 5-(4-Chlorophenoxy)-1,2,4-trichlorobenzene, Benzene, 1,2,4-trichloro-5-(4-chlorophenoxy)-, Benzene, 5-(4-chlorophenoxy)-1,2,4-trichloro-
| Molecular Formula | C12H6Cl4O |
|---|---|
| Molecular Weight | 305.92 g/mol |
| LogP | 6.0 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 307.91434 |
| Heavy Atoms | 17 |
| Complexity | 243.0 |
Chemical Identifiers
| CAS Number | 61328-45-8 |
|---|---|
| SMILES | C1=CC(=CC=C1OC2=CC(=C(C=C2Cl)Cl)Cl)Cl |
| InChIKey | KXOJXWNARBQHNX-UHFFFAOYSA-N |
Product Overview
2,4,4',5-Tetrachlorodiphenyl ether (CAS 61328-45-8), with molecular formula C12H6Cl4O and molecular weight 305.92 g/mol. IUPAC: 1,2,4-trichloro-5-(4-chlorophenoxy)benzene.
Chemical Property Profile of 2,4,4',5-Tetrachlorodiphenyl ether
Property Insights of 2,4,4',5-Tetrachlorodiphenyl ether
The XLogP value of 6.0 indicates that 2,4,4',5-Tetrachlorodiphenyl ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 2,4,4',5-Tetrachlorodiphenyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,4',5-Tetrachlorodiphenyl ether has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,4,4',5-Tetrachlorodiphenyl ether?
The CAS number of 2,4,4',5-Tetrachlorodiphenyl ether is 61328-45-8.
What is the molecular formula of 2,4,4',5-Tetrachlorodiphenyl ether?
The molecular formula of 2,4,4',5-Tetrachlorodiphenyl ether is C12H6Cl4O.
What is the molecular weight of 2,4,4',5-Tetrachlorodiphenyl ether?
The molecular weight of 2,4,4',5-Tetrachlorodiphenyl ether is 305.92 g/mol.
Where can I buy 2,4,4',5-Tetrachlorodiphenyl ether?
You can request a quote for 2,4,4',5-Tetrachlorodiphenyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,4',5-Tetrachlorodiphenyl ether?
Yes, KEHONG BIO provides custom synthesis services for 2,4,4',5-Tetrachlorodiphenyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.