Ethyl 3-((2-methoxy-2-oxoethyl)thio)propanoate
TL;DR: Ethyl 3-((2-methoxy-2-oxoethyl)thio)propanoate (CAS 109483-00-3) is a chemical compound with molecular formula C8H14O4S and molecular weight 206.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(2-methoxy-2-oxoethyl)sulfanylpropanoate
Also Known As: Ethyl 3-((2-methoxy-2-oxoethyl)thio)propanoate, starbld0042098, ethyl 3-(2-methoxy-2-oxoethyl)sulfanylpropanoate, Ethyl 3-[(2-methoxy-2-oxoethyl)thio]propionate, Ethyl 3-[(2-methoxy-2-oxoethyl)sulfanyl]propanoate
| Molecular Formula | C8H14O4S |
|---|---|
| Molecular Weight | 206.06 g/mol |
| LogP | 0.8458 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 206.06128 |
| Heavy Atoms | 13 |
| Complexity | 169.52696 |
Chemical Identifiers
| CAS Number | 109483-00-3 |
|---|---|
| SMILES | CCOC(=O)CCSCC(=O)OC |
Product Overview
Ethyl 3-((2-methoxy-2-oxoethyl)thio)propanoate (CAS 109483-00-3), with molecular formula C8H14O4S and molecular weight 206.06 g/mol. IUPAC: ethyl 3-(2-methoxy-2-oxoethyl)sulfanylpropanoate.
Chemical Property Profile of Ethyl 3-((2-methoxy-2-oxoethyl)thio)propanoate
Property Insights of Ethyl 3-((2-methoxy-2-oxoethyl)thio)propanoate
The XLogP value of 0.8458 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-((2-methoxy-2-oxoethyl)thio)propanoate. With a topological polar surface area (TPSA) of 52.6 Ų, Ethyl 3-((2-methoxy-2-oxoethyl)thio)propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3-((2-methoxy-2-oxoethyl)thio)propanoate 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 Ethyl 3-((2-methoxy-2-oxoethyl)thio)propanoate?
The CAS number of Ethyl 3-((2-methoxy-2-oxoethyl)thio)propanoate is 109483-00-3.
What is the molecular formula of Ethyl 3-((2-methoxy-2-oxoethyl)thio)propanoate?
The molecular formula of Ethyl 3-((2-methoxy-2-oxoethyl)thio)propanoate is C8H14O4S.
What is the molecular weight of Ethyl 3-((2-methoxy-2-oxoethyl)thio)propanoate?
The molecular weight of Ethyl 3-((2-methoxy-2-oxoethyl)thio)propanoate is 206.06 g/mol.
Where can I buy Ethyl 3-((2-methoxy-2-oxoethyl)thio)propanoate?
You can request a quote for Ethyl 3-((2-methoxy-2-oxoethyl)thio)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-((2-methoxy-2-oxoethyl)thio)propanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-((2-methoxy-2-oxoethyl)thio)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.