4-Oxo-4-(2-pyridyl)butyric acid
TL;DR: 4-Oxo-4-(2-pyridyl)butyric acid (CAS 5768-27-4) is a chemical compound with molecular formula C9H9NO3 and molecular weight 179.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-oxo-4-pyridin-2-ylbutanoic acid
Also Known As: 4-Oxo-4-(2-pyridyl)butyric acid, 4-Oxo-4-(pyridin-2-yl)butanoic acid, 4-oxo-4-pyridin-2-ylbutanoic acid, BERBERINESULFATETRIHYDRATE, gamma-oxo-2-pyridinebutyric acid
| Molecular Formula | C9H9NO3 |
|---|---|
| Molecular Weight | 179.06 g/mol |
| LogP | 1.1291 |
| Topological Polar Surface Area | 67.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 179.05824 |
| Heavy Atoms | 13 |
| Complexity | 307.89566 |
Chemical Identifiers
| CAS Number | 5768-27-4 |
|---|---|
| SMILES | C1=CC=NC(=C1)C(=O)CCC(=O)O |
Product Overview
4-Oxo-4-(2-pyridyl)butyric acid (CAS 5768-27-4), with molecular formula C9H9NO3 and molecular weight 179.06 g/mol. IUPAC: 4-oxo-4-pyridin-2-ylbutanoic acid.
Chemical Property Profile of 4-Oxo-4-(2-pyridyl)butyric acid
Property Insights of 4-Oxo-4-(2-pyridyl)butyric acid
The XLogP value of 1.1291 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Oxo-4-(2-pyridyl)butyric acid. The TPSA of 67.26 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Oxo-4-(2-pyridyl)butyric acid. Following Lipinski's Rule of Five, 4-Oxo-4-(2-pyridyl)butyric acid has 1 hydrogen bond donor(s) and 3 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-Oxo-4-(2-pyridyl)butyric acid?
The CAS number of 4-Oxo-4-(2-pyridyl)butyric acid is 5768-27-4.
What is the molecular formula of 4-Oxo-4-(2-pyridyl)butyric acid?
The molecular formula of 4-Oxo-4-(2-pyridyl)butyric acid is C9H9NO3.
What is the molecular weight of 4-Oxo-4-(2-pyridyl)butyric acid?
The molecular weight of 4-Oxo-4-(2-pyridyl)butyric acid is 179.06 g/mol.
Where can I buy 4-Oxo-4-(2-pyridyl)butyric acid?
You can request a quote for 4-Oxo-4-(2-pyridyl)butyric acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Oxo-4-(2-pyridyl)butyric acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Oxo-4-(2-pyridyl)butyric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.