2-(2-Chloroethylsulfanyl)ethyl acetate
TL;DR: 2-(2-Chloroethylsulfanyl)ethyl acetate (CAS 703-24-2) 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.
2-(2-chloroethylsulfanyl)ethyl acetate
Also Known As: 2-(2-chloroethylsulfanyl)ethyl acetate, 2-Chlor-2'-acetoxy-diethylsulfid, Acetic acid, 2-(2-chloroethylthio)ethyl ester, 2-[(2-Chloroethyl)sulfanyl]ethyl acetate, 2-[(2-Chloroethyl)sulfanyl]ethyl acetate #
| Molecular Formula | C6H11ClO2S |
|---|---|
| Molecular Weight | 182.02 g/mol |
| LogP | 1.4 |
| 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 | 703-24-2 |
|---|---|
| SMILES | CC(=O)OCCSCCCl |
| InChIKey | CQXHUYYYQDMLCB-UHFFFAOYSA-N |
Product Overview
2-(2-Chloroethylsulfanyl)ethyl acetate (CAS 703-24-2), with molecular formula C6H11ClO2S and molecular weight 182.02 g/mol. IUPAC: 2-(2-chloroethylsulfanyl)ethyl acetate.
Chemical Property Profile of 2-(2-Chloroethylsulfanyl)ethyl acetate
Property Insights of 2-(2-Chloroethylsulfanyl)ethyl acetate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Chloroethylsulfanyl)ethyl acetate. With a topological polar surface area (TPSA) of 51.6 Ų, 2-(2-Chloroethylsulfanyl)ethyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Chloroethylsulfanyl)ethyl 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 2-(2-Chloroethylsulfanyl)ethyl acetate?
The CAS number of 2-(2-Chloroethylsulfanyl)ethyl acetate is 703-24-2.
What is the molecular formula of 2-(2-Chloroethylsulfanyl)ethyl acetate?
The molecular formula of 2-(2-Chloroethylsulfanyl)ethyl acetate is C6H11ClO2S.
What is the molecular weight of 2-(2-Chloroethylsulfanyl)ethyl acetate?
The molecular weight of 2-(2-Chloroethylsulfanyl)ethyl acetate is 182.02 g/mol.
Where can I buy 2-(2-Chloroethylsulfanyl)ethyl acetate?
You can request a quote for 2-(2-Chloroethylsulfanyl)ethyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Chloroethylsulfanyl)ethyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Chloroethylsulfanyl)ethyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.