![Ethyl ({[(2-ethoxy-2-oxoethyl)sulfanyl]carbothioyl}sulfanyl)acetate structure](/static/products/108/108748-13-6.png)
Ethyl ({[(2-ethoxy-2-oxoethyl)sulfanyl]carbothioyl}sulfanyl)acetate
TL;DR: Ethyl ({[(2-ethoxy-2-oxoethyl)sulfanyl]carbothioyl}sulfanyl)acetate (CAS 108748-13-6) is a chemical compound with molecular formula C9H14O4S3 and molecular weight 282.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(2-ethoxy-2-oxoethyl)sulfanylcarbothioylsulfanylacetate
Also Known As: 4-thioxo-3,5-dithia-heptanedioic acid diethyl ester, ethyl 2-(2-ethoxy-2-oxoethyl)sulfanylcarbothioylsulfanylacetate, ethyl ({[(2-ethoxy-2-oxoethyl)sulfanyl]carbothioyl}sulfanyl)acetate
| Molecular Formula | C9H14O4S3 |
|---|---|
| Molecular Weight | 282.01 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 282.00543 |
| Heavy Atoms | 16 |
| Complexity | 231.0 |
Chemical Identifiers
| CAS Number | 108748-13-6 |
|---|---|
| SMILES | CCOC(=O)CSC(=S)SCC(=O)OCC |
| InChIKey | LDKHUJCVRLCAMA-UHFFFAOYSA-N |
Product Overview
Ethyl ({[(2-ethoxy-2-oxoethyl)sulfanyl]carbothioyl}sulfanyl)acetate (CAS 108748-13-6), with molecular formula C9H14O4S3 and molecular weight 282.01 g/mol. IUPAC: ethyl 2-(2-ethoxy-2-oxoethyl)sulfanylcarbothioylsulfanylacetate.
Chemical Property Profile of Ethyl ({[(2-ethoxy-2-oxoethyl)sulfanyl]carbothioyl}sulfanyl)acetate
Property Insights of Ethyl ({[(2-ethoxy-2-oxoethyl)sulfanyl]carbothioyl}sulfanyl)acetate
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl ({[(2-ethoxy-2-oxoethyl)sulfanyl]carbothioyl}sulfanyl)acetate. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl ({[(2-ethoxy-2-oxoethyl)sulfanyl]carbothioyl}sulfanyl)acetate. Following Lipinski's Rule of Five, Ethyl ({[(2-ethoxy-2-oxoethyl)sulfanyl]carbothioyl}sulfanyl)acetate has 0 hydrogen bond donor(s) and 7 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-ethoxy-2-oxoethyl)sulfanyl]carbothioyl}sulfanyl)acetate?
The CAS number of Ethyl ({[(2-ethoxy-2-oxoethyl)sulfanyl]carbothioyl}sulfanyl)acetate is 108748-13-6.
What is the molecular formula of Ethyl ({[(2-ethoxy-2-oxoethyl)sulfanyl]carbothioyl}sulfanyl)acetate?
The molecular formula of Ethyl ({[(2-ethoxy-2-oxoethyl)sulfanyl]carbothioyl}sulfanyl)acetate is C9H14O4S3.
What is the molecular weight of Ethyl ({[(2-ethoxy-2-oxoethyl)sulfanyl]carbothioyl}sulfanyl)acetate?
The molecular weight of Ethyl ({[(2-ethoxy-2-oxoethyl)sulfanyl]carbothioyl}sulfanyl)acetate is 282.01 g/mol.
Where can I buy Ethyl ({[(2-ethoxy-2-oxoethyl)sulfanyl]carbothioyl}sulfanyl)acetate?
You can request a quote for Ethyl ({[(2-ethoxy-2-oxoethyl)sulfanyl]carbothioyl}sulfanyl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl ({[(2-ethoxy-2-oxoethyl)sulfanyl]carbothioyl}sulfanyl)acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl ({[(2-ethoxy-2-oxoethyl)sulfanyl]carbothioyl}sulfanyl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.