1(2H)-Quinolinecarboxylic acid, 2-oxo-, ethyl ester
TL;DR: 1(2H)-Quinolinecarboxylic acid, 2-oxo-, ethyl ester (CAS 5470-63-3) is a chemical compound with molecular formula C12H11NO3 and molecular weight 217.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-oxoquinoline-1-carboxylate
Also Known As: 1(2H)-Quinolinecarboxylic acid, 2-oxo-, ethyl ester, ethyl 2-oxoquinoline-1(2h)-carboxylate, ethyl 2-oxoquinoline-1-carboxylate, Ethyl 2-oxo-1(2H)-quinolinecarboxylate, 2-Oxo-1(2H)-quinolinecarboxylic acid, ethyl ester
| Molecular Formula | C12H11NO3 |
|---|---|
| Molecular Weight | 217.07 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 217.0739 |
| Heavy Atoms | 16 |
| Complexity | 324.0 |
Chemical Identifiers
| CAS Number | 5470-63-3 |
|---|---|
| SMILES | CCOC(=O)N1C(=O)C=CC2=CC=CC=C21 |
| InChIKey | BHYKHYYQPFOAPJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1(2H)-Quinolinecarboxylic acid, 2-oxo-, ethyl ester (CAS 5470-63-3), with molecular formula C12H11NO3 and molecular weight 217.07 g/mol. IUPAC: ethyl 2-oxoquinoline-1-carboxylate.
Chemical Property Profile of 1(2H)-Quinolinecarboxylic acid, 2-oxo-, ethyl ester
Property Insights of 1(2H)-Quinolinecarboxylic acid, 2-oxo-, ethyl ester
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1(2H)-Quinolinecarboxylic acid, 2-oxo-, ethyl ester. With a topological polar surface area (TPSA) of 46.6 Ų, 1(2H)-Quinolinecarboxylic acid, 2-oxo-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1(2H)-Quinolinecarboxylic acid, 2-oxo-, ethyl ester has 0 hydrogen bond donor(s) and 3 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 1(2H)-Quinolinecarboxylic acid, 2-oxo-, ethyl ester?
The CAS number of 1(2H)-Quinolinecarboxylic acid, 2-oxo-, ethyl ester is 5470-63-3.
What is the molecular formula of 1(2H)-Quinolinecarboxylic acid, 2-oxo-, ethyl ester?
The molecular formula of 1(2H)-Quinolinecarboxylic acid, 2-oxo-, ethyl ester is C12H11NO3.
What is the molecular weight of 1(2H)-Quinolinecarboxylic acid, 2-oxo-, ethyl ester?
The molecular weight of 1(2H)-Quinolinecarboxylic acid, 2-oxo-, ethyl ester is 217.07 g/mol.
Where can I buy 1(2H)-Quinolinecarboxylic acid, 2-oxo-, ethyl ester?
You can request a quote for 1(2H)-Quinolinecarboxylic acid, 2-oxo-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1(2H)-Quinolinecarboxylic acid, 2-oxo-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 1(2H)-Quinolinecarboxylic acid, 2-oxo-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.