4-Fluorophenetole
TL;DR: 4-Fluorophenetole (CAS 459-26-7) is a chemical compound with molecular formula C8H9FO and molecular weight 140.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethoxy-4-fluorobenzene
Also Known As: 4-Fluorophenetole, 1-Ethoxy-4-fluorobenzene, p-Fluorophenetole, 4-Ethoxyfluorobenzene, Phenetole, p-fluoro-
| Molecular Formula | C8H9FO |
|---|---|
| Molecular Weight | 140.06 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 140.06374 |
| Heavy Atoms | 10 |
| Complexity | 87.0 |
Chemical Identifiers
| CAS Number | 459-26-7 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)F |
| InChIKey | PURLWQWDGIIYBG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Fluorophenetole (CAS 459-26-7), with molecular formula C8H9FO and molecular weight 140.06 g/mol. IUPAC: 1-ethoxy-4-fluorobenzene.
Chemical Property Profile of 4-Fluorophenetole
Property Insights of 4-Fluorophenetole
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Fluorophenetole. With a topological polar surface area (TPSA) of 9.2 Ų, 4-Fluorophenetole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Fluorophenetole has 0 hydrogen bond donor(s) and 2 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-Fluorophenetole?
The CAS number of 4-Fluorophenetole is 459-26-7.
What is the molecular formula of 4-Fluorophenetole?
The molecular formula of 4-Fluorophenetole is C8H9FO.
What is the molecular weight of 4-Fluorophenetole?
The molecular weight of 4-Fluorophenetole is 140.06 g/mol.
Where can I buy 4-Fluorophenetole?
You can request a quote for 4-Fluorophenetole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Fluorophenetole?
Yes, KEHONG BIO provides custom synthesis services for 4-Fluorophenetole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.