4-Oxo-piperidine-3-carboxylic acid ethyl ester
TL;DR: 4-Oxo-piperidine-3-carboxylic acid ethyl ester (CAS 67848-59-3) is a chemical compound with molecular formula C8H13NO3 and molecular weight 171.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-oxopiperidine-3-carboxylate
Also Known As: Ethyl 4-oxopiperidine-3-carboxylate, 4-Oxo-piperidine-3-carboxylic acid ethyl ester, 3-carbethoxy-4piperidone, 3-carbethoxy-4-piperidone, 3-carbethoxy-4-oxopiperidine
| Molecular Formula | C8H13NO3 |
|---|---|
| Molecular Weight | 171.09 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 171.08954 |
| Heavy Atoms | 12 |
| Complexity | 191.0 |
Chemical Identifiers
| CAS Number | 67848-59-3 |
|---|---|
| SMILES | CCOC(=O)C1CNCCC1=O |
| InChIKey | RIOSMHYBRAQVHD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Oxo-piperidine-3-carboxylic acid ethyl ester (CAS 67848-59-3), with molecular formula C8H13NO3 and molecular weight 171.09 g/mol. IUPAC: ethyl 4-oxopiperidine-3-carboxylate.
Chemical Property Profile of 4-Oxo-piperidine-3-carboxylic acid ethyl ester
Property Insights of 4-Oxo-piperidine-3-carboxylic acid ethyl ester
The XLogP value of -0.3 indicates that 4-Oxo-piperidine-3-carboxylic acid ethyl ester is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 55.4 Ų, 4-Oxo-piperidine-3-carboxylic acid ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Oxo-piperidine-3-carboxylic acid ethyl ester 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 4-Oxo-piperidine-3-carboxylic acid ethyl ester?
The CAS number of 4-Oxo-piperidine-3-carboxylic acid ethyl ester is 67848-59-3.
What is the molecular formula of 4-Oxo-piperidine-3-carboxylic acid ethyl ester?
The molecular formula of 4-Oxo-piperidine-3-carboxylic acid ethyl ester is C8H13NO3.
What is the molecular weight of 4-Oxo-piperidine-3-carboxylic acid ethyl ester?
The molecular weight of 4-Oxo-piperidine-3-carboxylic acid ethyl ester is 171.09 g/mol.
Where can I buy 4-Oxo-piperidine-3-carboxylic acid ethyl ester?
You can request a quote for 4-Oxo-piperidine-3-carboxylic acid ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Oxo-piperidine-3-carboxylic acid ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 4-Oxo-piperidine-3-carboxylic acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.