4-Chloronicotinic acid
TL;DR: 4-Chloronicotinic acid (CAS 10177-29-4) is a chemical compound with molecular formula C6H4ClNO2 and molecular weight 156.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloropyridine-3-carboxylic acid
Also Known As: 4-Chloronicotinic acid, 4-Chloropyridine-3-carboxylic acid, 4-Chloronicotinicacid, 4-chlornicotinsaure, 4-Chloro-3-pyridinecarboxylic acid
| Molecular Formula | C6H4ClNO2 |
|---|---|
| Molecular Weight | 156.99 g/mol |
| LogP | 1.4332 |
| Topological Polar Surface Area | 50.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 156.99306 |
| Heavy Atoms | 10 |
| Complexity | 261.67966 |
Chemical Identifiers
| CAS Number | 10177-29-4 |
|---|---|
| SMILES | C1=CN=CC(=C1Cl)C(=O)O |
Product Overview
4-Chloronicotinic acid (CAS 10177-29-4), with molecular formula C6H4ClNO2 and molecular weight 156.99 g/mol. IUPAC: 4-chloropyridine-3-carboxylic acid.
Chemical Property Profile of 4-Chloronicotinic acid
Property Insights of 4-Chloronicotinic acid
The XLogP value of 1.4332 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloronicotinic acid. With a topological polar surface area (TPSA) of 50.19 Ų, 4-Chloronicotinic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloronicotinic acid 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-Chloronicotinic acid?
The CAS number of 4-Chloronicotinic acid is 10177-29-4.
What is the molecular formula of 4-Chloronicotinic acid?
The molecular formula of 4-Chloronicotinic acid is C6H4ClNO2.
What is the molecular weight of 4-Chloronicotinic acid?
The molecular weight of 4-Chloronicotinic acid is 156.99 g/mol.
Where can I buy 4-Chloronicotinic acid?
You can request a quote for 4-Chloronicotinic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloronicotinic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloronicotinic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.