6-Chloro-2-(trifluoromethyl)quinolin-4(1H)-one
TL;DR: 6-Chloro-2-(trifluoromethyl)quinolin-4(1H)-one (CAS 18706-21-3) is a chemical compound with molecular formula C10H5ClF3NO and molecular weight 247.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-2-(trifluoromethyl)-1H-quinolin-4-one
Also Known As: 6-chloro-2-(trifluoromethyl)quinolin-4-ol, 6-Chloro-4-hydroxy-2-(trifluoromethyl)quinoline, Toprilidine, 6-chloro-2-(trifluoromethyl)-1H-quinolin-4-one, 6-Chloro-2-trifluoromethyl-quinolin-4-ol
| Molecular Formula | C10H5ClF3NO |
|---|---|
| Molecular Weight | 247.00 g/mol |
| LogP | 3.2003 |
| Topological Polar Surface Area | 32.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 247.00117 |
| Heavy Atoms | 16 |
| Complexity | 603.0161 |
Chemical Identifiers
| CAS Number | 18706-21-3 |
|---|---|
| SMILES | C1=CC2=C(C=C1Cl)C(=O)C=C(N2)C(F)(F)F |
Product Overview
6-Chloro-2-(trifluoromethyl)quinolin-4(1H)-one (CAS 18706-21-3), with molecular formula C10H5ClF3NO and molecular weight 247.00 g/mol. IUPAC: 6-chloro-2-(trifluoromethyl)-1H-quinolin-4-one.
Chemical Property Profile of 6-Chloro-2-(trifluoromethyl)quinolin-4(1H)-one
Property Insights of 6-Chloro-2-(trifluoromethyl)quinolin-4(1H)-one
The XLogP value of 3.2003 indicates that 6-Chloro-2-(trifluoromethyl)quinolin-4(1H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.86 Ų, 6-Chloro-2-(trifluoromethyl)quinolin-4(1H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Chloro-2-(trifluoromethyl)quinolin-4(1H)-one has 1 hydrogen bond donor(s) and 1 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 6-Chloro-2-(trifluoromethyl)quinolin-4(1H)-one?
The CAS number of 6-Chloro-2-(trifluoromethyl)quinolin-4(1H)-one is 18706-21-3.
What is the molecular formula of 6-Chloro-2-(trifluoromethyl)quinolin-4(1H)-one?
The molecular formula of 6-Chloro-2-(trifluoromethyl)quinolin-4(1H)-one is C10H5ClF3NO.
What is the molecular weight of 6-Chloro-2-(trifluoromethyl)quinolin-4(1H)-one?
The molecular weight of 6-Chloro-2-(trifluoromethyl)quinolin-4(1H)-one is 247.00 g/mol.
Where can I buy 6-Chloro-2-(trifluoromethyl)quinolin-4(1H)-one?
You can request a quote for 6-Chloro-2-(trifluoromethyl)quinolin-4(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chloro-2-(trifluoromethyl)quinolin-4(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-2-(trifluoromethyl)quinolin-4(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.