8-Chloro-4-oxo-5-(trifluoromethyl)-1,4-dihydroquinoline-3-carboxylic acid
TL;DR: 8-Chloro-4-oxo-5-(trifluoromethyl)-1,4-dihydroquinoline-3-carboxylic acid (CAS 641993-18-2) is a chemical compound with molecular formula C11H5ClF3NO3 and molecular weight 290.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-chloro-4-oxo-5-(trifluoromethyl)-1H-quinoline-3-carboxylic acid
Also Known As: 8-chloro-4-oxo-5-(trifluoromethyl)-1,4-dihydroquinoline-3-carboxylic acid, 8-chloro-4-oxo-5-(trifluoromethyl)-1H-quinoline-3-carboxylic Acid, 8-Chloro-4-hydroxy-5-(trifluoromethyl)quinoline-3-carboxylic acid, ,8-chloro-4-oxo-5-(trifluoroMethyl)-1,4-dihydroquinoline-3-carboxylic acid
| Molecular Formula | C11H5ClF3NO3 |
|---|---|
| Molecular Weight | 290.99 g/mol |
| LogP | 2.8985 |
| Topological Polar Surface Area | 70.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 290.991 |
| Heavy Atoms | 19 |
| Complexity | 736.26843 |
Chemical Identifiers
| CAS Number | 641993-18-2 |
|---|---|
| SMILES | C1=CC(=C2C(=C1C(F)(F)F)C(=O)C(=CN2)C(=O)O)Cl |
Product Overview
8-Chloro-4-oxo-5-(trifluoromethyl)-1,4-dihydroquinoline-3-carboxylic acid (CAS 641993-18-2), with molecular formula C11H5ClF3NO3 and molecular weight 290.99 g/mol. IUPAC: 8-chloro-4-oxo-5-(trifluoromethyl)-1H-quinoline-3-carboxylic acid.
Chemical Property Profile of 8-Chloro-4-oxo-5-(trifluoromethyl)-1,4-dihydroquinoline-3-carboxylic acid
Property Insights of 8-Chloro-4-oxo-5-(trifluoromethyl)-1,4-dihydroquinoline-3-carboxylic acid
The XLogP value of 2.8985 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Chloro-4-oxo-5-(trifluoromethyl)-1,4-dihydroquinoline-3-carboxylic acid. The TPSA of 70.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-Chloro-4-oxo-5-(trifluoromethyl)-1,4-dihydroquinoline-3-carboxylic acid. Following Lipinski's Rule of Five, 8-Chloro-4-oxo-5-(trifluoromethyl)-1,4-dihydroquinoline-3-carboxylic acid has 2 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 8-Chloro-4-oxo-5-(trifluoromethyl)-1,4-dihydroquinoline-3-carboxylic acid?
The CAS number of 8-Chloro-4-oxo-5-(trifluoromethyl)-1,4-dihydroquinoline-3-carboxylic acid is 641993-18-2.
What is the molecular formula of 8-Chloro-4-oxo-5-(trifluoromethyl)-1,4-dihydroquinoline-3-carboxylic acid?
The molecular formula of 8-Chloro-4-oxo-5-(trifluoromethyl)-1,4-dihydroquinoline-3-carboxylic acid is C11H5ClF3NO3.
What is the molecular weight of 8-Chloro-4-oxo-5-(trifluoromethyl)-1,4-dihydroquinoline-3-carboxylic acid?
The molecular weight of 8-Chloro-4-oxo-5-(trifluoromethyl)-1,4-dihydroquinoline-3-carboxylic acid is 290.99 g/mol.
Where can I buy 8-Chloro-4-oxo-5-(trifluoromethyl)-1,4-dihydroquinoline-3-carboxylic acid?
You can request a quote for 8-Chloro-4-oxo-5-(trifluoromethyl)-1,4-dihydroquinoline-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 8-Chloro-4-oxo-5-(trifluoromethyl)-1,4-dihydroquinoline-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 8-Chloro-4-oxo-5-(trifluoromethyl)-1,4-dihydroquinoline-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.