4-Ethoxy-6-fluorocoumarin
TL;DR: 4-Ethoxy-6-fluorocoumarin (CAS 527751-30-0) is a chemical compound with molecular formula C11H9FO3 and molecular weight 208.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethoxy-6-fluorochromen-2-one
Also Known As: 4-Ethoxy-6-fluorocoumarin, 4-ethoxy-6-fluoro-2H-chromen-2-one, 4-ethoxy-6-fluorochromen-2-one, 2H-1-Benzopyran-2-one, 4-ethoxy-6-fluoro-, 2H-1-Benzopyran-2-one,4-ethoxy-6-fluoro-(9CI)
| Molecular Formula | C11H9FO3 |
|---|---|
| Molecular Weight | 208.05 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.05357 |
| Heavy Atoms | 15 |
| Complexity | 288.0 |
Chemical Identifiers
| CAS Number | 527751-30-0 |
|---|---|
| SMILES | CCOC1=CC(=O)OC2=C1C=C(C=C2)F |
| InChIKey | ZBDYDCPYWZBECM-UHFFFAOYSA-N |
Product Overview
4-Ethoxy-6-fluorocoumarin (CAS 527751-30-0), with molecular formula C11H9FO3 and molecular weight 208.05 g/mol. IUPAC: 4-ethoxy-6-fluorochromen-2-one.
Chemical Property Profile of 4-Ethoxy-6-fluorocoumarin
Property Insights of 4-Ethoxy-6-fluorocoumarin
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Ethoxy-6-fluorocoumarin. With a topological polar surface area (TPSA) of 35.5 Ų, 4-Ethoxy-6-fluorocoumarin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Ethoxy-6-fluorocoumarin has 0 hydrogen bond donor(s) and 4 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-Ethoxy-6-fluorocoumarin?
The CAS number of 4-Ethoxy-6-fluorocoumarin is 527751-30-0.
What is the molecular formula of 4-Ethoxy-6-fluorocoumarin?
The molecular formula of 4-Ethoxy-6-fluorocoumarin is C11H9FO3.
What is the molecular weight of 4-Ethoxy-6-fluorocoumarin?
The molecular weight of 4-Ethoxy-6-fluorocoumarin is 208.05 g/mol.
Where can I buy 4-Ethoxy-6-fluorocoumarin?
You can request a quote for 4-Ethoxy-6-fluorocoumarin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Ethoxy-6-fluorocoumarin?
Yes, KEHONG BIO provides custom synthesis services for 4-Ethoxy-6-fluorocoumarin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.