4-(2-Ethoxy-ethoxy)-3-oxo-butyric acid ethyl ester
TL;DR: 4-(2-Ethoxy-ethoxy)-3-oxo-butyric acid ethyl ester (CAS 677326-77-1) is a chemical compound with molecular formula C10H18O5 and molecular weight 218.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(2-ethoxyethoxy)-3-oxobutanoate
Also Known As: 4-(2-Ethoxy-ethoxy)-3-oxo-butyric acid ethyl ester, ethyl 4-(2-ethoxyethoxy)-3-oxobutanoate, 4-(2-ethoxyethoxy)-3-oxo-butyric acid ethyl ester, Ethyl 4-(2-ethoxyethoxy)-3-oxo-butanoate
| Molecular Formula | C10H18O5 |
|---|---|
| Molecular Weight | 218.12 g/mol |
| LogP | 0.5618 |
| Topological Polar Surface Area | 61.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 218.11542 |
| Heavy Atoms | 15 |
| Complexity | 190.25177 |
Chemical Identifiers
| CAS Number | 677326-77-1 |
|---|---|
| SMILES | CCOCCOCC(=O)CC(=O)OCC |
Product Overview
4-(2-Ethoxy-ethoxy)-3-oxo-butyric acid ethyl ester (CAS 677326-77-1), with molecular formula C10H18O5 and molecular weight 218.12 g/mol. IUPAC: ethyl 4-(2-ethoxyethoxy)-3-oxobutanoate.
Chemical Property Profile of 4-(2-Ethoxy-ethoxy)-3-oxo-butyric acid ethyl ester
Property Insights of 4-(2-Ethoxy-ethoxy)-3-oxo-butyric acid ethyl ester
The XLogP value of 0.5618 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Ethoxy-ethoxy)-3-oxo-butyric acid ethyl ester. The TPSA of 61.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-Ethoxy-ethoxy)-3-oxo-butyric acid ethyl ester. Following Lipinski's Rule of Five, 4-(2-Ethoxy-ethoxy)-3-oxo-butyric acid ethyl ester has 0 hydrogen bond donor(s) and 5 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-(2-Ethoxy-ethoxy)-3-oxo-butyric acid ethyl ester?
The CAS number of 4-(2-Ethoxy-ethoxy)-3-oxo-butyric acid ethyl ester is 677326-77-1.
What is the molecular formula of 4-(2-Ethoxy-ethoxy)-3-oxo-butyric acid ethyl ester?
The molecular formula of 4-(2-Ethoxy-ethoxy)-3-oxo-butyric acid ethyl ester is C10H18O5.
What is the molecular weight of 4-(2-Ethoxy-ethoxy)-3-oxo-butyric acid ethyl ester?
The molecular weight of 4-(2-Ethoxy-ethoxy)-3-oxo-butyric acid ethyl ester is 218.12 g/mol.
Where can I buy 4-(2-Ethoxy-ethoxy)-3-oxo-butyric acid ethyl ester?
You can request a quote for 4-(2-Ethoxy-ethoxy)-3-oxo-butyric 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-(2-Ethoxy-ethoxy)-3-oxo-butyric acid ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Ethoxy-ethoxy)-3-oxo-butyric acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.