Ethyl 2-oxo-1,2,3,4-tetrahydroquinoline-4-carboxylate
TL;DR: Ethyl 2-oxo-1,2,3,4-tetrahydroquinoline-4-carboxylate (CAS 67752-52-7) is a chemical compound with molecular formula C12H13NO3 and molecular weight 219.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-oxo-3,4-dihydro-1H-quinoline-4-carboxylate
Also Known As: ethyl 2-oxo-1,2,3,4-tetrahydroquinoline-4-carboxylate, ethyl 2-oxo-3,4-dihydro-1H-quinoline-4-carboxylate, J1.398.611H, Ethyl 1,2,3,4-tetrahydro-2-oxoquinoline-4-carboxylate, ethyl2-oxo-1,2,3,4-tetrahydroquinoline-4-carboxylate
| Molecular Formula | C12H13NO3 |
|---|---|
| Molecular Weight | 219.09 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 219.08954 |
| Heavy Atoms | 16 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 67752-52-7 |
|---|---|
| SMILES | CCOC(=O)C1CC(=O)NC2=CC=CC=C12 |
| InChIKey | WSBUDAJUVYHBLM-UHFFFAOYSA-N |
Product Overview
Ethyl 2-oxo-1,2,3,4-tetrahydroquinoline-4-carboxylate (CAS 67752-52-7), with molecular formula C12H13NO3 and molecular weight 219.09 g/mol. IUPAC: ethyl 2-oxo-3,4-dihydro-1H-quinoline-4-carboxylate.
Chemical Property Profile of Ethyl 2-oxo-1,2,3,4-tetrahydroquinoline-4-carboxylate
Property Insights of Ethyl 2-oxo-1,2,3,4-tetrahydroquinoline-4-carboxylate
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-oxo-1,2,3,4-tetrahydroquinoline-4-carboxylate. With a topological polar surface area (TPSA) of 55.4 Ų, Ethyl 2-oxo-1,2,3,4-tetrahydroquinoline-4-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-oxo-1,2,3,4-tetrahydroquinoline-4-carboxylate has 1 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 Ethyl 2-oxo-1,2,3,4-tetrahydroquinoline-4-carboxylate?
The CAS number of Ethyl 2-oxo-1,2,3,4-tetrahydroquinoline-4-carboxylate is 67752-52-7.
What is the molecular formula of Ethyl 2-oxo-1,2,3,4-tetrahydroquinoline-4-carboxylate?
The molecular formula of Ethyl 2-oxo-1,2,3,4-tetrahydroquinoline-4-carboxylate is C12H13NO3.
What is the molecular weight of Ethyl 2-oxo-1,2,3,4-tetrahydroquinoline-4-carboxylate?
The molecular weight of Ethyl 2-oxo-1,2,3,4-tetrahydroquinoline-4-carboxylate is 219.09 g/mol.
Where can I buy Ethyl 2-oxo-1,2,3,4-tetrahydroquinoline-4-carboxylate?
You can request a quote for Ethyl 2-oxo-1,2,3,4-tetrahydroquinoline-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-oxo-1,2,3,4-tetrahydroquinoline-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-oxo-1,2,3,4-tetrahydroquinoline-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.