![Ethyl [(2-chloroethyl)sulfanyl]acetate structure](/static/products/4332/4332-56-3.webp)
Ethyl [(2-chloroethyl)sulfanyl]acetate
TL;DR: Ethyl [(2-chloroethyl)sulfanyl]acetate (CAS 4332-56-3) is a chemical compound with molecular formula C6H11ClO2S and molecular weight 182.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(2-chloroethylsulfanyl)acetate
Also Known As: DABS, ethyl[(2-chloroethyl)sulfanyl]acetate, Ethyl [(2-chloroethyl)sulfanyl]acetate, ethyl 2-((2-chloroethyl)thio)acetate, ethyl 2-(2-chloroethylsulfanyl)acetate
| Molecular Formula | C6H11ClO2S |
|---|---|
| Molecular Weight | 182.02 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 51.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 182.01683 |
| Heavy Atoms | 10 |
| Complexity | 97.0 |
Chemical Identifiers
| CAS Number | 4332-56-3 |
|---|---|
| SMILES | CCOC(=O)CSCCCl |
| InChIKey | BVJWZFFOCWNENA-UHFFFAOYSA-N |
Product Overview
Ethyl [(2-chloroethyl)sulfanyl]acetate (CAS 4332-56-3), with molecular formula C6H11ClO2S and molecular weight 182.02 g/mol. IUPAC: ethyl 2-(2-chloroethylsulfanyl)acetate.
Chemical Property Profile of Ethyl [(2-chloroethyl)sulfanyl]acetate
Property Insights of Ethyl [(2-chloroethyl)sulfanyl]acetate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl [(2-chloroethyl)sulfanyl]acetate. With a topological polar surface area (TPSA) of 51.6 Ų, Ethyl [(2-chloroethyl)sulfanyl]acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl [(2-chloroethyl)sulfanyl]acetate has 0 hydrogen bond donor(s) and 3 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-chloroethyl)sulfanyl]acetate?
The CAS number of Ethyl [(2-chloroethyl)sulfanyl]acetate is 4332-56-3.
What is the molecular formula of Ethyl [(2-chloroethyl)sulfanyl]acetate?
The molecular formula of Ethyl [(2-chloroethyl)sulfanyl]acetate is C6H11ClO2S.
What is the molecular weight of Ethyl [(2-chloroethyl)sulfanyl]acetate?
The molecular weight of Ethyl [(2-chloroethyl)sulfanyl]acetate is 182.02 g/mol.
Where can I buy Ethyl [(2-chloroethyl)sulfanyl]acetate?
You can request a quote for Ethyl [(2-chloroethyl)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-chloroethyl)sulfanyl]acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl [(2-chloroethyl)sulfanyl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.