柠嗪酸
TL;DR: 柠嗪酸 (CAS 99-11-6) is a chemical compound with molecular formula C6H5NO4 and molecular weight 155.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
柠嗪酸
2-hydroxy-6-oxo-1H-pyridine-4-carboxylic acid
Also Known As: CITRAZINIC ACID, 2,6-Dihydroxyisonicotinic acid, 2,6-Dihydroxypyridine-4-carboxylic acid, CitrazinicAcid, Kyselina citrazinova
| Molecular Formula | C6H5NO4 |
|---|---|
| Molecular Weight | 155.02 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 86.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 155.02185 |
| Heavy Atoms | 11 |
| Complexity | 276.0 |
Chemical Identifiers
| CAS Number | 99-11-6 |
|---|---|
| SMILES | C1=C(C=C(NC1=O)O)C(=O)O |
| InChIKey | CSGQJHQYWJLPKY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
柠嗪酸 (CAS 99-11-6), with molecular formula C6H5NO4 and molecular weight 155.02 g/mol. IUPAC: 2-hydroxy-6-oxo-1H-pyridine-4-carboxylic acid.
Chemical Property Profile of 柠嗪酸
Property Insights of 柠嗪酸
The XLogP value of -0.7 indicates that 柠嗪酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 86.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 柠嗪酸. Following Lipinski's Rule of Five, 柠嗪酸 has 3 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 柠嗪酸?
The CAS number of 柠嗪酸 is 99-11-6.
What is the molecular formula of 柠嗪酸?
The molecular formula of 柠嗪酸 is C6H5NO4.
What is the molecular weight of 柠嗪酸?
The molecular weight of 柠嗪酸 is 155.02 g/mol.
Where can I buy 柠嗪酸?
You can request a quote for 柠嗪酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 柠嗪酸?
Yes, KEHONG BIO provides custom synthesis services for 柠嗪酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.