4-Pyridineacetic acid hydrochloride
TL;DR: 4-Pyridineacetic acid hydrochloride (CAS 6622-91-9) is a chemical compound with molecular formula C7H8ClNO2 and molecular weight 173.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-pyridin-4-ylacetic acid;hydrochloride
Also Known As: 4-Pyridineacetic acid hydrochloride, 4-Pyridylacetic acid hydrochloride, 2-(pyridin-4-yl)acetic acid hydrochloride, null, 4-Carboxymethylpyridinium chloride
| Molecular Formula | C7H8ClNO2 |
|---|---|
| Molecular Weight | 173.02 g/mol |
| LogP | 1.13 |
| Topological Polar Surface Area | 50.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 173.02435 |
| Heavy Atoms | 11 |
| Complexity | 119.0 |
Chemical Identifiers
| CAS Number | 6622-91-9 |
|---|---|
| SMILES | C1=CN=CC=C1CC(=O)O.Cl |
| InChIKey | WKJRYVOTVRPAFN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Pyridineacetic acid hydrochloride (CAS 6622-91-9), with molecular formula C7H8ClNO2 and molecular weight 173.02 g/mol. IUPAC: 2-pyridin-4-ylacetic acid;hydrochloride.
Chemical Property Profile of 4-Pyridineacetic acid hydrochloride
Property Insights of 4-Pyridineacetic acid hydrochloride
The XLogP value of 1.13 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Pyridineacetic acid hydrochloride. With a topological polar surface area (TPSA) of 50.2 Ų, 4-Pyridineacetic acid hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Pyridineacetic acid hydrochloride has 2 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-Pyridineacetic acid hydrochloride?
The CAS number of 4-Pyridineacetic acid hydrochloride is 6622-91-9.
What is the molecular formula of 4-Pyridineacetic acid hydrochloride?
The molecular formula of 4-Pyridineacetic acid hydrochloride is C7H8ClNO2.
What is the molecular weight of 4-Pyridineacetic acid hydrochloride?
The molecular weight of 4-Pyridineacetic acid hydrochloride is 173.02 g/mol.
Where can I buy 4-Pyridineacetic acid hydrochloride?
You can request a quote for 4-Pyridineacetic acid hydrochloride 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 hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 4-Pyridineacetic acid hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.