5-Ethoxy-5-oxo-4-(2,2,2-trifluoroacetamido)pentanoic acid
TL;DR: 5-Ethoxy-5-oxo-4-(2,2,2-trifluoroacetamido)pentanoic acid (CAS 88494-57-9) is a chemical compound with molecular formula C9H12F3NO5 and molecular weight 271.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethoxy-5-oxo-4-[(2,2,2-trifluoroacetyl)amino]pentanoic acid
Also Known As: 5-ethoxy-5-oxo-4-[(2,2,2-trifluoroacetyl)amino]pentanoic Acid, 5-Ethoxy-5-oxo-4-(2,2,2-trifluoroacetamido)pentanoic acid
| Molecular Formula | C9H12F3NO5 |
|---|---|
| Molecular Weight | 271.07 g/mol |
| LogP | 0.4614 |
| Topological Polar Surface Area | 92.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 271.06674 |
| Heavy Atoms | 18 |
| Complexity | 328.65503 |
Chemical Identifiers
| CAS Number | 88494-57-9 |
|---|---|
| SMILES | CCOC(=O)C(CCC(=O)O)NC(=O)C(F)(F)F |
Product Overview
5-Ethoxy-5-oxo-4-(2,2,2-trifluoroacetamido)pentanoic acid (CAS 88494-57-9), with molecular formula C9H12F3NO5 and molecular weight 271.07 g/mol. IUPAC: 5-ethoxy-5-oxo-4-[(2,2,2-trifluoroacetyl)amino]pentanoic acid.
Chemical Property Profile of 5-Ethoxy-5-oxo-4-(2,2,2-trifluoroacetamido)pentanoic acid
Property Insights of 5-Ethoxy-5-oxo-4-(2,2,2-trifluoroacetamido)pentanoic acid
The XLogP value of 0.4614 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Ethoxy-5-oxo-4-(2,2,2-trifluoroacetamido)pentanoic acid. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Ethoxy-5-oxo-4-(2,2,2-trifluoroacetamido)pentanoic acid. Following Lipinski's Rule of Five, 5-Ethoxy-5-oxo-4-(2,2,2-trifluoroacetamido)pentanoic acid has 2 hydrogen bond donor(s) and 4 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-Ethoxy-5-oxo-4-(2,2,2-trifluoroacetamido)pentanoic acid?
The CAS number of 5-Ethoxy-5-oxo-4-(2,2,2-trifluoroacetamido)pentanoic acid is 88494-57-9.
What is the molecular formula of 5-Ethoxy-5-oxo-4-(2,2,2-trifluoroacetamido)pentanoic acid?
The molecular formula of 5-Ethoxy-5-oxo-4-(2,2,2-trifluoroacetamido)pentanoic acid is C9H12F3NO5.
What is the molecular weight of 5-Ethoxy-5-oxo-4-(2,2,2-trifluoroacetamido)pentanoic acid?
The molecular weight of 5-Ethoxy-5-oxo-4-(2,2,2-trifluoroacetamido)pentanoic acid is 271.07 g/mol.
Where can I buy 5-Ethoxy-5-oxo-4-(2,2,2-trifluoroacetamido)pentanoic acid?
You can request a quote for 5-Ethoxy-5-oxo-4-(2,2,2-trifluoroacetamido)pentanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Ethoxy-5-oxo-4-(2,2,2-trifluoroacetamido)pentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Ethoxy-5-oxo-4-(2,2,2-trifluoroacetamido)pentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.