8-methyl-7-nitro-4-oxo-1H-quinoline-3-carboxylic acid
TL;DR: 8-methyl-7-nitro-4-oxo-1H-quinoline-3-carboxylic acid (CAS 145363-57-1) is a chemical compound with molecular formula C11H8N2O5 and molecular weight 248.04332 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-methyl-7-nitro-4-oxo-1H-quinoline-3-carboxylic acid
Also Known As: 8-methyl-7-nitro-4-oxo-1H-quinoline-3-carboxylic Acid, 3-Quinolinecarboxylic acid, 1,4-dihydro-8-methyl-7-nitro-4-oxo-
Technical Specifications
| Molecular Formula | C11H8N2O5 |
| Molecular Weight | 248.04332 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 112.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 248.04332 Da |
| Heavy Atoms | 18 |
| Complexity | 439.0 |
| SMILES | CC1=C(C=CC2=C1NC=C(C2=O)C(=O)O)[N+](=O)[O-] |
| InChIKey | DYAFIFLIMLJSQT-UHFFFAOYSA-N |
Chemical Property Profile of 8-methyl-7-nitro-4-oxo-1H-quinoline-3-carboxylic acid
Property Insights of 8-methyl-7-nitro-4-oxo-1H-quinoline-3-carboxylic acid
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-methyl-7-nitro-4-oxo-1H-quinoline-3-carboxylic acid. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-methyl-7-nitro-4-oxo-1H-quinoline-3-carboxylic acid. Following Lipinski's Rule of Five, 8-methyl-7-nitro-4-oxo-1H-quinoline-3-carboxylic acid has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 8-methyl-7-nitro-4-oxo-1H-quinoline-3-carboxylic acid?
The CAS number of 8-methyl-7-nitro-4-oxo-1H-quinoline-3-carboxylic acid is 145363-57-1.
What is the molecular formula of 8-methyl-7-nitro-4-oxo-1H-quinoline-3-carboxylic acid?
The molecular formula of 8-methyl-7-nitro-4-oxo-1H-quinoline-3-carboxylic acid is C11H8N2O5.
What is the molecular weight of 8-methyl-7-nitro-4-oxo-1H-quinoline-3-carboxylic acid?
The molecular weight of 8-methyl-7-nitro-4-oxo-1H-quinoline-3-carboxylic acid is 248.04332 g/mol.
Where can I buy 8-methyl-7-nitro-4-oxo-1H-quinoline-3-carboxylic acid?
You can request a quote for 8-methyl-7-nitro-4-oxo-1H-quinoline-3-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 8-methyl-7-nitro-4-oxo-1H-quinoline-3-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 8-methyl-7-nitro-4-oxo-1H-quinoline-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.