![5-{[2-Chloro-5-(trifluoromethyl)phenyl]amino}-5-oxopentanoic acid structure](/static/products/1998/199803-46-8.webp)
5-{[2-Chloro-5-(trifluoromethyl)phenyl]amino}-5-oxopentanoic acid
TL;DR: 5-{[2-Chloro-5-(trifluoromethyl)phenyl]amino}-5-oxopentanoic acid (CAS 199803-46-8) is a chemical compound with molecular formula C12H11ClF3NO3 and molecular weight 309.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[2-chloro-5-(trifluoromethyl)anilino]-5-oxopentanoic acid
Also Known As: 5-{[2-chloro-5-(trifluoromethyl)phenyl]amino}-5-oxopentanoic acid, 5-[2-chloro-5-(trifluoromethyl)anilino]-5-oxopentanoic acid, 5-([2-Chloro-5-(trifluoromethyl)phenyl]amino)-5-oxopentanoic acid, 4-{[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}butanoic acid, Pentanoic acid, 5-[[2-chloro-5-(trifluoromethyl)phenyl]amino]-5-oxo-
| Molecular Formula | C12H11ClF3NO3 |
|---|---|
| Molecular Weight | 309.04 g/mol |
| LogP | 3.5522 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 309.03796 |
| Heavy Atoms | 20 |
| Complexity | 517.1593 |
Chemical Identifiers
| CAS Number | 199803-46-8 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(F)(F)F)NC(=O)CCCC(=O)O)Cl |
Product Overview
5-{[2-Chloro-5-(trifluoromethyl)phenyl]amino}-5-oxopentanoic acid (CAS 199803-46-8), with molecular formula C12H11ClF3NO3 and molecular weight 309.04 g/mol. IUPAC: 5-[2-chloro-5-(trifluoromethyl)anilino]-5-oxopentanoic acid.
Chemical Property Profile of 5-{[2-Chloro-5-(trifluoromethyl)phenyl]amino}-5-oxopentanoic acid
Property Insights of 5-{[2-Chloro-5-(trifluoromethyl)phenyl]amino}-5-oxopentanoic acid
The XLogP value of 3.5522 indicates that 5-{[2-Chloro-5-(trifluoromethyl)phenyl]amino}-5-oxopentanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-{[2-Chloro-5-(trifluoromethyl)phenyl]amino}-5-oxopentanoic acid. Following Lipinski's Rule of Five, 5-{[2-Chloro-5-(trifluoromethyl)phenyl]amino}-5-oxopentanoic 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 5-{[2-Chloro-5-(trifluoromethyl)phenyl]amino}-5-oxopentanoic acid?
The CAS number of 5-{[2-Chloro-5-(trifluoromethyl)phenyl]amino}-5-oxopentanoic acid is 199803-46-8.
What is the molecular formula of 5-{[2-Chloro-5-(trifluoromethyl)phenyl]amino}-5-oxopentanoic acid?
The molecular formula of 5-{[2-Chloro-5-(trifluoromethyl)phenyl]amino}-5-oxopentanoic acid is C12H11ClF3NO3.
What is the molecular weight of 5-{[2-Chloro-5-(trifluoromethyl)phenyl]amino}-5-oxopentanoic acid?
The molecular weight of 5-{[2-Chloro-5-(trifluoromethyl)phenyl]amino}-5-oxopentanoic acid is 309.04 g/mol.
Where can I buy 5-{[2-Chloro-5-(trifluoromethyl)phenyl]amino}-5-oxopentanoic acid?
You can request a quote for 5-{[2-Chloro-5-(trifluoromethyl)phenyl]amino}-5-oxopentanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-{[2-Chloro-5-(trifluoromethyl)phenyl]amino}-5-oxopentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-{[2-Chloro-5-(trifluoromethyl)phenyl]amino}-5-oxopentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.