4-Hydroxy-7-trifluoromethylquinoline-3-carboxylic acid
TL;DR: 4-Hydroxy-7-trifluoromethylquinoline-3-carboxylic acid (CAS 574-92-5) is a chemical compound with molecular formula C11H6F3NO3 and molecular weight 257.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-oxo-7-(trifluoromethyl)-1H-quinoline-3-carboxylic acid
Also Known As: 4-Hydroxy-7-(trifluoromethyl)quinoline-3-carboxylic acid, 4-Hydroxy-7-trifluoromethyl-3-quinolinecarboxylic acid, 4-oxo-7-(trifluoromethyl)-1,4-dihydroquinoline-3-carboxylic acid, 4-oxo-7-(trifluoromethyl)-1H-quinoline-3-carboxylic acid, 4-Hydroxy-7-(trifluoromethyl)-quinoline-3-carboxylic acid
| Molecular Formula | C11H6F3NO3 |
|---|---|
| Molecular Weight | 257.03 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 257.02997 |
| Heavy Atoms | 18 |
| Complexity | 416.0 |
Chemical Identifiers
| CAS Number | 574-92-5 |
|---|---|
| SMILES | C1=CC2=C(C=C1C(F)(F)F)NC=C(C2=O)C(=O)O |
| InChIKey | BIRIVPOTERXIOW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Hydroxy-7-trifluoromethylquinoline-3-carboxylic acid (CAS 574-92-5), with molecular formula C11H6F3NO3 and molecular weight 257.03 g/mol. IUPAC: 4-oxo-7-(trifluoromethyl)-1H-quinoline-3-carboxylic acid.
Chemical Property Profile of 4-Hydroxy-7-trifluoromethylquinoline-3-carboxylic acid
Property Insights of 4-Hydroxy-7-trifluoromethylquinoline-3-carboxylic acid
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Hydroxy-7-trifluoromethylquinoline-3-carboxylic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Hydroxy-7-trifluoromethylquinoline-3-carboxylic acid. Following Lipinski's Rule of Five, 4-Hydroxy-7-trifluoromethylquinoline-3-carboxylic acid has 2 hydrogen bond donor(s) and 7 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-Hydroxy-7-trifluoromethylquinoline-3-carboxylic acid?
The CAS number of 4-Hydroxy-7-trifluoromethylquinoline-3-carboxylic acid is 574-92-5.
What is the molecular formula of 4-Hydroxy-7-trifluoromethylquinoline-3-carboxylic acid?
The molecular formula of 4-Hydroxy-7-trifluoromethylquinoline-3-carboxylic acid is C11H6F3NO3.
What is the molecular weight of 4-Hydroxy-7-trifluoromethylquinoline-3-carboxylic acid?
The molecular weight of 4-Hydroxy-7-trifluoromethylquinoline-3-carboxylic acid is 257.03 g/mol.
Where can I buy 4-Hydroxy-7-trifluoromethylquinoline-3-carboxylic acid?
You can request a quote for 4-Hydroxy-7-trifluoromethylquinoline-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Hydroxy-7-trifluoromethylquinoline-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Hydroxy-7-trifluoromethylquinoline-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.