5-硝基喹哪啶酸
TL;DR: 5-硝基喹哪啶酸 (CAS 525-47-3) is a chemical compound with molecular formula C10H6N2O4 and molecular weight 218.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-硝基喹哪啶酸
5-nitroquinoline-2-carboxylic acid
Also Known As: 5-Nitroquinoline-2-carboxylic acid, 5-NITROQUINALDIC ACID, 5-Nitroquinaldinic acid, Quinaldic acid, 5-nitro-, 5-Nitro-2-quinolinecarboxylic acid
| Molecular Formula | C10H6N2O4 |
|---|---|
| Molecular Weight | 218.03 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 96.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 218.03276 |
| Heavy Atoms | 16 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 525-47-3 |
|---|---|
| SMILES | C1=CC2=C(C=CC(=N2)C(=O)O)C(=C1)[N+](=O)[O-] |
| InChIKey | PHELEJSJZGCLEJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-硝基喹哪啶酸 (CAS 525-47-3), with molecular formula C10H6N2O4 and molecular weight 218.03 g/mol. IUPAC: 5-nitroquinoline-2-carboxylic acid.
Chemical Property Profile of 5-硝基喹哪啶酸
Property Insights of 5-硝基喹哪啶酸
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-硝基喹哪啶酸. The TPSA of 96.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-硝基喹哪啶酸. Following Lipinski's Rule of Five, 5-硝基喹哪啶酸 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-硝基喹哪啶酸?
The CAS number of 5-硝基喹哪啶酸 is 525-47-3.
What is the molecular formula of 5-硝基喹哪啶酸?
The molecular formula of 5-硝基喹哪啶酸 is C10H6N2O4.
What is the molecular weight of 5-硝基喹哪啶酸?
The molecular weight of 5-硝基喹哪啶酸 is 218.03 g/mol.
Where can I buy 5-硝基喹哪啶酸?
You can request a quote for 5-硝基喹哪啶酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-硝基喹哪啶酸?
Yes, KEHONG BIO provides custom synthesis services for 5-硝基喹哪啶酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.