4-Chlorophenyl phenyl ether
TL;DR: 4-Chlorophenyl phenyl ether (CAS 7005-72-3) is a chemical compound with molecular formula C12H9ClO and molecular weight 204.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-4-phenoxybenzene
Also Known As: 4-Chlorodiphenyl ether, 1-Chloro-4-phenoxybenzene, 4-Chlorophenyl phenyl ether, p-Chlorodiphenyl oxide, Chlorodiphenyl ether
| Molecular Formula | C12H9ClO |
|---|---|
| Molecular Weight | 204.03 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 204.0342 |
| Heavy Atoms | 14 |
| Complexity | 158.0 |
| Melting Point | -8 °C |
| Boiling Point | 543 to 285.0 °C at 760 mmHg |
| Density | 1.2026 at 15.0 °C |
| Solubility | 3.3 mg/l @ 25 °C |
| Vapor Pressure | 0.0027 [mmHg] |
| Refractive Index | 1.599 |
Chemical Identifiers
| CAS Number | 7005-72-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC2=CC=C(C=C2)Cl |
| InChIKey | PGPNJCAMHOJTEF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Chlorophenyl phenyl ether (CAS 7005-72-3), with molecular formula C12H9ClO and molecular weight 204.03 g/mol. IUPAC: 1-chloro-4-phenoxybenzene.
Chemical Property Profile of 4-Chlorophenyl phenyl ether
Property Insights of 4-Chlorophenyl phenyl ether
The XLogP value of 4.3 indicates that 4-Chlorophenyl phenyl 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-Chlorophenyl phenyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chlorophenyl phenyl 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-Chlorophenyl phenyl ether?
The CAS number of 4-Chlorophenyl phenyl ether is 7005-72-3.
What is the molecular formula of 4-Chlorophenyl phenyl ether?
The molecular formula of 4-Chlorophenyl phenyl ether is C12H9ClO.
What is the molecular weight of 4-Chlorophenyl phenyl ether?
The molecular weight of 4-Chlorophenyl phenyl ether is 204.03 g/mol.
Where can I buy 4-Chlorophenyl phenyl ether?
You can request a quote for 4-Chlorophenyl phenyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chlorophenyl phenyl ether?
Yes, KEHONG BIO provides custom synthesis services for 4-Chlorophenyl phenyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.