5-Chloro-6-hydroxynicotinic acid
TL;DR: 5-Chloro-6-hydroxynicotinic acid (CAS 54127-63-8) is a chemical compound with molecular formula C6H4ClNO3 and molecular weight 172.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-6-oxo-1H-pyridine-3-carboxylic acid
Also Known As: 5-Chloro-6-hydroxynicotinic acid, 5-Chloro-6-hydroxynicotinicacid, 3-Chloro-2-hydroxypyridine-5-carboxylic acid, 5-chloro-6-hydroxypyridine-3-carboxylic acid, MixCom3_000058
| Molecular Formula | C6H4ClNO3 |
|---|---|
| Molecular Weight | 172.99 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 172.98798 |
| Heavy Atoms | 11 |
| Complexity | 280.0 |
Chemical Identifiers
| CAS Number | 54127-63-8 |
|---|---|
| SMILES | C1=C(C(=O)NC=C1C(=O)O)Cl |
| InChIKey | OLTRUTPHSBQWAZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Chloro-6-hydroxynicotinic acid (CAS 54127-63-8), with molecular formula C6H4ClNO3 and molecular weight 172.99 g/mol. IUPAC: 5-chloro-6-oxo-1H-pyridine-3-carboxylic acid.
Chemical Property Profile of 5-Chloro-6-hydroxynicotinic acid
Property Insights of 5-Chloro-6-hydroxynicotinic acid
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Chloro-6-hydroxynicotinic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Chloro-6-hydroxynicotinic acid. Following Lipinski's Rule of Five, 5-Chloro-6-hydroxynicotinic acid 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 5-Chloro-6-hydroxynicotinic acid?
The CAS number of 5-Chloro-6-hydroxynicotinic acid is 54127-63-8.
What is the molecular formula of 5-Chloro-6-hydroxynicotinic acid?
The molecular formula of 5-Chloro-6-hydroxynicotinic acid is C6H4ClNO3.
What is the molecular weight of 5-Chloro-6-hydroxynicotinic acid?
The molecular weight of 5-Chloro-6-hydroxynicotinic acid is 172.99 g/mol.
Where can I buy 5-Chloro-6-hydroxynicotinic acid?
You can request a quote for 5-Chloro-6-hydroxynicotinic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloro-6-hydroxynicotinic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-6-hydroxynicotinic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.