4,4'-Dichlorodiphenyl ether
TL;DR: 4,4'-Dichlorodiphenyl ether (CAS 2444-89-5) is a chemical compound with molecular formula C12H8Cl2O and molecular weight 238.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-4-(4-chlorophenoxy)benzene
Also Known As: 4-Chlorophenyl ether, 4,4'-DICHLORODIPHENYL ETHER, Bis(p-chlorophenyl) ether, 1-Chloro-4-(4-chlorophenoxy)benzene, Ether, bis(p-chlorophenyl)
| Molecular Formula | C12H8Cl2O |
|---|---|
| Molecular Weight | 238.00 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 237.99522 |
| Heavy Atoms | 15 |
| Complexity | 162.0 |
Chemical Identifiers
| CAS Number | 2444-89-5 |
|---|---|
| SMILES | C1=CC(=CC=C1OC2=CC=C(C=C2)Cl)Cl |
| InChIKey | URUJZHZLCCIILC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,4'-Dichlorodiphenyl ether (CAS 2444-89-5), with molecular formula C12H8Cl2O and molecular weight 238.00 g/mol. IUPAC: 1-chloro-4-(4-chlorophenoxy)benzene.
Chemical Property Profile of 4,4'-Dichlorodiphenyl ether
Property Insights of 4,4'-Dichlorodiphenyl ether
The XLogP value of 4.0 indicates that 4,4'-Dichlorodiphenyl 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, 4,4'-Dichlorodiphenyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4'-Dichlorodiphenyl ether has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,4'-Dichlorodiphenyl ether?
The CAS number of 4,4'-Dichlorodiphenyl ether is 2444-89-5.
What is the molecular formula of 4,4'-Dichlorodiphenyl ether?
The molecular formula of 4,4'-Dichlorodiphenyl ether is C12H8Cl2O.
What is the molecular weight of 4,4'-Dichlorodiphenyl ether?
The molecular weight of 4,4'-Dichlorodiphenyl ether is 238.00 g/mol.
Where can I buy 4,4'-Dichlorodiphenyl ether?
You can request a quote for 4,4'-Dichlorodiphenyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-Dichlorodiphenyl ether?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-Dichlorodiphenyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.