1,2,4-Trithiolane
TL;DR: 1,2,4-Trithiolane (CAS 289-16-7) is a chemical compound with molecular formula C2H4S3 and molecular weight 123.94752 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2,4-trithiolane
Also Known As: 1,2,4-TRITHIOLANE, 1,2,4-Trithiacyclopentane, KST-1B2819, OF568IX8QZ
Application Areas
Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C2H4S3 |
| Molecular Weight | 123.94752 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 75.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 123.94752 Da |
| Heavy Atoms | 5 |
| Complexity | 24.0 |
| Melting Point | 104.00 °C. @ 760.00 mm Hg |
| Boiling Point | 224.00 to 226.00 °C. @ 760.00 mm Hg |
| Vapor Pressure | 0.8 [mmHg] |
| SMILES | C1SCSS1 |
| InChIKey | QHGFEUAAQKJXDI-UHFFFAOYSA-N |
Product Description
Applications: 1,2,4-Trithiolane is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
A pharmaceutical intermediate supplied by CoreyChem, 1,2,4-Trithiolane (CAS 289-16-7) has the molecular formula C2H4S3 and a molecular weight of 123.95 g/mol. Synonyms include 1,2,4-TRITHIOLANE and 1,2,4-Trithiacyclopentane.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 1,2,4-Trithiolane
Property Insights of 1,2,4-Trithiolane
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,4-Trithiolane. The TPSA of 75.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2,4-Trithiolane. Following Lipinski's Rule of Five, 1,2,4-Trithiolane 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
What is the CAS number of 1,2,4-Trithiolane?
The CAS number of 1,2,4-Trithiolane is 289-16-7.
What is the molecular formula of 1,2,4-Trithiolane?
The molecular formula of 1,2,4-Trithiolane is C2H4S3.
What is the molecular weight of 1,2,4-Trithiolane?
The molecular weight of 1,2,4-Trithiolane is 123.94752 g/mol.
What are the applications of 1,2,4-Trithiolane?
1,2,4-Trithiolane is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy 1,2,4-Trithiolane?
You can request a quote for 1,2,4-Trithiolane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,2,4-Trithiolane?
Yes, CoreyChem provides custom synthesis services for 1,2,4-Trithiolane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.