4-Pyridineacetic acid 1-oxide
TL;DR: 4-Pyridineacetic acid 1-oxide (CAS 89791-90-2) is a chemical compound with molecular formula C7H7NO3 and molecular weight 153.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-oxidopyridin-1-ium-4-yl)acetic acid
Also Known As: 4-pyridineacetic acid 1-oxide, 4-pyridine acetic acid N-oxide, 4-pyridine-acetic acid 1-oxide, 2-(1-oxidopyridin-4-yl)acetic Acid, 2-(1-oxidopyridin-1-ium-4-yl)acetic acid
| Molecular Formula | C7H7NO3 |
|---|---|
| Molecular Weight | 153.04 g/mol |
| LogP | -0.0529 |
| Topological Polar Surface Area | 64.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 153.04259 |
| Heavy Atoms | 11 |
| Complexity | 254.89313 |
Chemical Identifiers
| CAS Number | 89791-90-2 |
|---|---|
| SMILES | C1=C[N+](=CC=C1CC(=O)O)[O-] |
Product Overview
4-Pyridineacetic acid 1-oxide (CAS 89791-90-2), with molecular formula C7H7NO3 and molecular weight 153.04 g/mol. IUPAC: 2-(1-oxidopyridin-1-ium-4-yl)acetic acid.
Chemical Property Profile of 4-Pyridineacetic acid 1-oxide
Property Insights of 4-Pyridineacetic acid 1-oxide
The XLogP value of -0.0529 indicates that 4-Pyridineacetic acid 1-oxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 64.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Pyridineacetic acid 1-oxide. Following Lipinski's Rule of Five, 4-Pyridineacetic acid 1-oxide has 1 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 4-Pyridineacetic acid 1-oxide?
The CAS number of 4-Pyridineacetic acid 1-oxide is 89791-90-2.
What is the molecular formula of 4-Pyridineacetic acid 1-oxide?
The molecular formula of 4-Pyridineacetic acid 1-oxide is C7H7NO3.
What is the molecular weight of 4-Pyridineacetic acid 1-oxide?
The molecular weight of 4-Pyridineacetic acid 1-oxide is 153.04 g/mol.
Where can I buy 4-Pyridineacetic acid 1-oxide?
You can request a quote for 4-Pyridineacetic acid 1-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Pyridineacetic acid 1-oxide?
Yes, KEHONG BIO provides custom synthesis services for 4-Pyridineacetic acid 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.