2-Carbomethoxy-3-quinolinecarboxylic acid
TL;DR: 2-Carbomethoxy-3-quinolinecarboxylic acid (CAS 113556-30-2) is a chemical compound with molecular formula C12H9NO4 and molecular weight 231.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxycarbonylquinoline-3-carboxylic acid
Also Known As: 2-methoxycarbonylquinoline-3-carboxylate, 2-methoxycarbonylquinoline-3-carboxylic Acid, 2-carbomethoxy-3-quinolinecarboxylic acid
| Molecular Formula | C12H9NO4 |
|---|---|
| Molecular Weight | 231.05 g/mol |
| LogP | 1.7196 |
| Topological Polar Surface Area | 76.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 231.05316 |
| Heavy Atoms | 17 |
| Complexity | 606.4772 |
Chemical Identifiers
| CAS Number | 113556-30-2 |
|---|---|
| SMILES | COC(=O)C1=NC2=CC=CC=C2C=C1C(=O)O |
Product Overview
2-Carbomethoxy-3-quinolinecarboxylic acid (CAS 113556-30-2), with molecular formula C12H9NO4 and molecular weight 231.05 g/mol. IUPAC: 2-methoxycarbonylquinoline-3-carboxylic acid.
Chemical Property Profile of 2-Carbomethoxy-3-quinolinecarboxylic acid
Property Insights of 2-Carbomethoxy-3-quinolinecarboxylic acid
The XLogP value of 1.7196 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Carbomethoxy-3-quinolinecarboxylic acid. The TPSA of 76.49 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Carbomethoxy-3-quinolinecarboxylic acid. Following Lipinski's Rule of Five, 2-Carbomethoxy-3-quinolinecarboxylic acid has 1 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 2-Carbomethoxy-3-quinolinecarboxylic acid?
The CAS number of 2-Carbomethoxy-3-quinolinecarboxylic acid is 113556-30-2.
What is the molecular formula of 2-Carbomethoxy-3-quinolinecarboxylic acid?
The molecular formula of 2-Carbomethoxy-3-quinolinecarboxylic acid is C12H9NO4.
What is the molecular weight of 2-Carbomethoxy-3-quinolinecarboxylic acid?
The molecular weight of 2-Carbomethoxy-3-quinolinecarboxylic acid is 231.05 g/mol.
Where can I buy 2-Carbomethoxy-3-quinolinecarboxylic acid?
You can request a quote for 2-Carbomethoxy-3-quinolinecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Carbomethoxy-3-quinolinecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Carbomethoxy-3-quinolinecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.