5-Nitroquinaldic acid
TL;DR: 5-Nitroquinaldic acid (CAS 525-47-3) is a chemical compound with molecular formula C10H6N2O4 and molecular weight 218.03276 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
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
Application Areas
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H6N2O4 |
| Molecular Weight | 218.03276 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 96.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 218.03276 Da |
| Heavy Atoms | 16 |
| Complexity | 302.0 |
| SMILES | C1=CC2=C(C=CC(=N2)C(=O)O)C(=C1)[N+](=O)[O-] |
| InChIKey | PHELEJSJZGCLEJ-UHFFFAOYSA-N |
Product Description
Applications: 5-Nitroquinaldic acid is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 5-Nitroquinaldic acid (CAS 525-47-3) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
5-Nitroquinaldic acid (CAS 525-47-3) is a heterocyclic building block with the molecular formula C10H6N2O4 and a molecular weight of 218.03 g/mol. It is also known as 5-Nitroquinoline-2-carboxylic acid and 5-NITROQUINALDIC ACID.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 5-Nitroquinaldic acid
Property Insights of 5-Nitroquinaldic acid
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Nitroquinaldic acid. The TPSA of 96.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Nitroquinaldic acid. Following Lipinski's Rule of Five, 5-Nitroquinaldic 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
What is the CAS number of 5-Nitroquinaldic acid?
The CAS number of 5-Nitroquinaldic acid is 525-47-3.
What is the molecular formula of 5-Nitroquinaldic acid?
The molecular formula of 5-Nitroquinaldic acid is C10H6N2O4.
What is the molecular weight of 5-Nitroquinaldic acid?
The molecular weight of 5-Nitroquinaldic acid is 218.03276 g/mol.
What are the applications of 5-Nitroquinaldic acid?
5-Nitroquinaldic acid is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 5-Nitroquinaldic acid (CAS...
Where can I buy 5-Nitroquinaldic acid?
You can request a quote for 5-Nitroquinaldic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Nitroquinaldic acid?
Yes, CoreyChem provides custom synthesis services for 5-Nitroquinaldic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.