Ethyl 6-fluoro-4-hydroxyquinoline-3-carboxylate
TL;DR: Ethyl 6-fluoro-4-hydroxyquinoline-3-carboxylate (CAS 32111-05-0) is a chemical compound with molecular formula C12H10FNO3 and molecular weight 235.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-fluoro-4-oxo-1H-quinoline-3-carboxylate
Also Known As: ethyl 6-fluoro-4-hydroxyquinoline-3-carboxylate, null, ethyl 6-fluoro-4-oxo-1H-quinoline-3-carboxylate, ethyl 6-fluoro-4-hydroxy-3-quinolinecarboxylate, ZERO/005096
| Molecular Formula | C12H10FNO3 |
|---|---|
| Molecular Weight | 235.06 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 235.06447 |
| Heavy Atoms | 17 |
| Complexity | 367.0 |
Chemical Identifiers
| CAS Number | 32111-05-0 |
|---|---|
| SMILES | CCOC(=O)C1=CNC2=C(C1=O)C=C(C=C2)F |
| InChIKey | LNPRCADPRULVTR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 6-fluoro-4-hydroxyquinoline-3-carboxylate (CAS 32111-05-0), with molecular formula C12H10FNO3 and molecular weight 235.06 g/mol. IUPAC: ethyl 6-fluoro-4-oxo-1H-quinoline-3-carboxylate.
Chemical Property Profile of Ethyl 6-fluoro-4-hydroxyquinoline-3-carboxylate
Property Insights of Ethyl 6-fluoro-4-hydroxyquinoline-3-carboxylate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 6-fluoro-4-hydroxyquinoline-3-carboxylate. With a topological polar surface area (TPSA) of 55.4 Ų, Ethyl 6-fluoro-4-hydroxyquinoline-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 6-fluoro-4-hydroxyquinoline-3-carboxylate has 1 hydrogen bond donor(s) and 5 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 Ethyl 6-fluoro-4-hydroxyquinoline-3-carboxylate?
The CAS number of Ethyl 6-fluoro-4-hydroxyquinoline-3-carboxylate is 32111-05-0.
What is the molecular formula of Ethyl 6-fluoro-4-hydroxyquinoline-3-carboxylate?
The molecular formula of Ethyl 6-fluoro-4-hydroxyquinoline-3-carboxylate is C12H10FNO3.
What is the molecular weight of Ethyl 6-fluoro-4-hydroxyquinoline-3-carboxylate?
The molecular weight of Ethyl 6-fluoro-4-hydroxyquinoline-3-carboxylate is 235.06 g/mol.
Where can I buy Ethyl 6-fluoro-4-hydroxyquinoline-3-carboxylate?
You can request a quote for Ethyl 6-fluoro-4-hydroxyquinoline-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 6-fluoro-4-hydroxyquinoline-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 6-fluoro-4-hydroxyquinoline-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.