5-Nitropicolinic acid
TL;DR: 5-Nitropicolinic acid (CAS 30651-24-2) is a chemical compound with molecular formula C6H4N2O4 and molecular weight 168.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-nitropyridine-2-carboxylic acid
Also Known As: 5-Nitropicolinic acid, 5-nitropyridine-2-carboxylic acid, 5-Nitro-2-pyridinecarboxylic acid, 5-Nitro-2-picolinic Acid, null
| Molecular Formula | C6H4N2O4 |
|---|---|
| Molecular Weight | 168.02 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 96.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 168.0171 |
| Heavy Atoms | 12 |
| Complexity | 200.0 |
Chemical Identifiers
| CAS Number | 30651-24-2 |
|---|---|
| SMILES | C1=CC(=NC=C1[N+](=O)[O-])C(=O)O |
| InChIKey | QKYRCTVBMNXTBT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Nitropicolinic acid (CAS 30651-24-2), with molecular formula C6H4N2O4 and molecular weight 168.02 g/mol. IUPAC: 5-nitropyridine-2-carboxylic acid.
Chemical Property Profile of 5-Nitropicolinic acid
Property Insights of 5-Nitropicolinic acid
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Nitropicolinic acid. The TPSA of 96.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Nitropicolinic acid. Following Lipinski's Rule of Five, 5-Nitropicolinic acid has 1 hydrogen bond donor(s) and 5 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-Nitropicolinic acid?
The CAS number of 5-Nitropicolinic acid is 30651-24-2.
What is the molecular formula of 5-Nitropicolinic acid?
The molecular formula of 5-Nitropicolinic acid is C6H4N2O4.
What is the molecular weight of 5-Nitropicolinic acid?
The molecular weight of 5-Nitropicolinic acid is 168.02 g/mol.
Where can I buy 5-Nitropicolinic acid?
You can request a quote for 5-Nitropicolinic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Nitropicolinic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Nitropicolinic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.