2-Vinyl-(4H)-1,3-dithiin
TL;DR: 2-Vinyl-(4H)-1,3-dithiin (CAS 8424-93-9) is a chemical compound with molecular formula C=CC1SCC=CS1 and molecular weight 144.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethenyl-4H-1,3-dithiine
Also Known As: 2-Vdtii, 2-Vinyl-4H-1,3-dithiine, 2-Vinyl-4H-1,3-dithiin, vinyldithiin II, 2-Ethenyl-4H-1,3-dithiin
| Molecular Formula | C=CC1SCC=CS1 |
|---|---|
| Molecular Weight | 144.01 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 144.00674 |
| Heavy Atoms | 8 |
| Complexity | 107.0 |
Chemical Identifiers
| CAS Number | 8424-93-9 |
|---|---|
| SMILES | C=CC1SCC=CS1 |
| InChIKey | XUKBDTUPIIADOP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Vinyl-(4H)-1,3-dithiin (CAS 8424-93-9), with molecular formula C=CC1SCC=CS1 and molecular weight 144.01 g/mol. IUPAC: 2-ethenyl-4H-1,3-dithiine.
Chemical Property Profile of 2-Vinyl-(4H)-1,3-dithiin
Property Insights of 2-Vinyl-(4H)-1,3-dithiin
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Vinyl-(4H)-1,3-dithiin. With a topological polar surface area (TPSA) of 50.6 Ų, 2-Vinyl-(4H)-1,3-dithiin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Vinyl-(4H)-1,3-dithiin 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-Vinyl-(4H)-1,3-dithiin?
The CAS number of 2-Vinyl-(4H)-1,3-dithiin is 8424-93-9.
What is the molecular formula of 2-Vinyl-(4H)-1,3-dithiin?
The molecular formula of 2-Vinyl-(4H)-1,3-dithiin is C=CC1SCC=CS1.
What is the molecular weight of 2-Vinyl-(4H)-1,3-dithiin?
The molecular weight of 2-Vinyl-(4H)-1,3-dithiin is 144.01 g/mol.
Where can I buy 2-Vinyl-(4H)-1,3-dithiin?
You can request a quote for 2-Vinyl-(4H)-1,3-dithiin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Vinyl-(4H)-1,3-dithiin?
Yes, KEHONG BIO provides custom synthesis services for 2-Vinyl-(4H)-1,3-dithiin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.