2-(2-Chloroethylthio)ethylthioethene
TL;DR: 2-(2-Chloroethylthio)ethylthioethene (CAS 13177-82-7) is a chemical compound with molecular formula C6H11ClS2 and molecular weight 182.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chloroethylsulfanyl)-2-ethenylsulfanylethane
Also Known As: 2-(2-Chloroethylthio)ethylthioethene, (2-Chloroethylthio)ethyl vinyl sulfide, KST-1A1082, ({2-[(2-chloroethyl)sulfanyl]ethyl}sulfanyl)ethene, [2-(2-Chloroethylthio)ethyl]vinyl sulfide
| Molecular Formula | C6H11ClS2 |
|---|---|
| Molecular Weight | 182.00 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 181.99907 |
| Heavy Atoms | 9 |
| Complexity | 66.0 |
Chemical Identifiers
| CAS Number | 13177-82-7 |
|---|---|
| SMILES | C=CSCCSCCCl |
| InChIKey | CBVAXGNCAZECCK-UHFFFAOYSA-N |
Product Overview
2-(2-Chloroethylthio)ethylthioethene (CAS 13177-82-7), with molecular formula C6H11ClS2 and molecular weight 182.00 g/mol. IUPAC: 1-(2-chloroethylsulfanyl)-2-ethenylsulfanylethane.
Chemical Property Profile of 2-(2-Chloroethylthio)ethylthioethene
Property Insights of 2-(2-Chloroethylthio)ethylthioethene
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Chloroethylthio)ethylthioethene. With a topological polar surface area (TPSA) of 50.6 Ų, 2-(2-Chloroethylthio)ethylthioethene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Chloroethylthio)ethylthioethene has 0 hydrogen bond donor(s) and 2 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-Chloroethylthio)ethylthioethene?
The CAS number of 2-(2-Chloroethylthio)ethylthioethene is 13177-82-7.
What is the molecular formula of 2-(2-Chloroethylthio)ethylthioethene?
The molecular formula of 2-(2-Chloroethylthio)ethylthioethene is C6H11ClS2.
What is the molecular weight of 2-(2-Chloroethylthio)ethylthioethene?
The molecular weight of 2-(2-Chloroethylthio)ethylthioethene is 182.00 g/mol.
Where can I buy 2-(2-Chloroethylthio)ethylthioethene?
You can request a quote for 2-(2-Chloroethylthio)ethylthioethene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Chloroethylthio)ethylthioethene?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Chloroethylthio)ethylthioethene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.