4-Hydroxynicotinic acid
TL;DR: 4-Hydroxynicotinic acid (CAS 609-70-1) is a chemical compound with molecular formula C6H5NO3 and molecular weight 139.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-oxo-1H-pyridine-3-carboxylic acid
Also Known As: 4-Hydroxynicotinic acid, 4-Hydroxypyridine-3-carboxylic acid, Odhpca, 4-Hydroxy-nicotinic acid, 4-oxo-1,4-dihydropyridine-3-carboxylic acid
| Molecular Formula | C6H5NO3 |
|---|---|
| Molecular Weight | 139.03 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 139.02695 |
| Heavy Atoms | 10 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 609-70-1 |
|---|---|
| SMILES | C1=CNC=C(C1=O)C(=O)O |
| InChIKey | CHCUBGPSZDGABM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Hydroxynicotinic acid (CAS 609-70-1), with molecular formula C6H5NO3 and molecular weight 139.03 g/mol. IUPAC: 4-oxo-1H-pyridine-3-carboxylic acid.
Chemical Property Profile of 4-Hydroxynicotinic acid
Property Insights of 4-Hydroxynicotinic acid
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Hydroxynicotinic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Hydroxynicotinic acid. Following Lipinski's Rule of Five, 4-Hydroxynicotinic 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 4-Hydroxynicotinic acid?
The CAS number of 4-Hydroxynicotinic acid is 609-70-1.
What is the molecular formula of 4-Hydroxynicotinic acid?
The molecular formula of 4-Hydroxynicotinic acid is C6H5NO3.
What is the molecular weight of 4-Hydroxynicotinic acid?
The molecular weight of 4-Hydroxynicotinic acid is 139.03 g/mol.
Where can I buy 4-Hydroxynicotinic acid?
You can request a quote for 4-Hydroxynicotinic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Hydroxynicotinic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Hydroxynicotinic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.