ethyl 4-ethoxy-2-oxopent-3-enoate
TL;DR: ethyl 4-ethoxy-2-oxopent-3-enoate (CAS 181512-62-9) is a chemical compound with molecular formula C9H14O4 and molecular weight 186.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-ethoxy-2-oxopent-3-enoate
Also Known As: ethyl 4-ethoxy-2-oxopent-3-enoate, 3-Pentenoicacid,4-ethoxy-2-oxo-,ethylester
| Molecular Formula | C9H14O4 |
|---|---|
| Molecular Weight | 186.09 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 186.0892 |
| Heavy Atoms | 13 |
| Complexity | 218.0 |
Chemical Identifiers
| CAS Number | 181512-62-9 |
|---|---|
| SMILES | CCOC(=CC(=O)C(=O)OCC)C |
| InChIKey | JGZDFJZKXHTQDM-UHFFFAOYSA-N |
Product Overview
ethyl 4-ethoxy-2-oxopent-3-enoate (CAS 181512-62-9), with molecular formula C9H14O4 and molecular weight 186.09 g/mol. IUPAC: ethyl 4-ethoxy-2-oxopent-3-enoate.
Chemical Property Profile of ethyl 4-ethoxy-2-oxopent-3-enoate
Property Insights of ethyl 4-ethoxy-2-oxopent-3-enoate
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 4-ethoxy-2-oxopent-3-enoate. With a topological polar surface area (TPSA) of 52.6 Ų, ethyl 4-ethoxy-2-oxopent-3-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl 4-ethoxy-2-oxopent-3-enoate has 0 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 ethyl 4-ethoxy-2-oxopent-3-enoate?
The CAS number of ethyl 4-ethoxy-2-oxopent-3-enoate is 181512-62-9.
What is the molecular formula of ethyl 4-ethoxy-2-oxopent-3-enoate?
The molecular formula of ethyl 4-ethoxy-2-oxopent-3-enoate is C9H14O4.
What is the molecular weight of ethyl 4-ethoxy-2-oxopent-3-enoate?
The molecular weight of ethyl 4-ethoxy-2-oxopent-3-enoate is 186.09 g/mol.
Where can I buy ethyl 4-ethoxy-2-oxopent-3-enoate?
You can request a quote for ethyl 4-ethoxy-2-oxopent-3-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 4-ethoxy-2-oxopent-3-enoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-ethoxy-2-oxopent-3-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.