1,3,5-Trithiane
TL;DR: 1,3,5-Trithiane (CAS 291-21-4) is a chemical compound with molecular formula C3H6S3 and molecular weight 137.96317 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,3,5-trithiane
Also Known As: 1,3,5-TRITHIANE, s-Trithiane, Thioform, sym-Trithian, Trithioformaldehyde
Application Areas
Top 5 of 16 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C3H6S3 |
| Molecular Weight | 137.96317 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 75.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 137.96317 Da |
| Heavy Atoms | 6 |
| Complexity | 21.0 |
| Melting Point | 220 °C |
| SMILES | C1SCSCS1 |
| InChIKey | LORRLQMLLQLPSJ-UHFFFAOYSA-N |
Product Description
Applications: 1,3,5-Trithiane 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. CoreyChem supplies 1,3,5-Trithiane (CAS 291-21-4) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
1,3,5-Trithiane (CAS 291-21-4) is a pharmaceutical intermediate with the molecular formula C3H6S3 and a molecular weight of 137.96 g/mol. It is also known as 1,3,5-TRITHIANE and s-Trithiane.
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 1,3,5-Trithiane
Property Insights of 1,3,5-Trithiane
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3,5-Trithiane. The TPSA of 75.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,5-Trithiane. Following Lipinski's Rule of Five, 1,3,5-Trithiane 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 1,3,5-Trithiane?
The CAS number of 1,3,5-Trithiane is 291-21-4.
What is the molecular formula of 1,3,5-Trithiane?
The molecular formula of 1,3,5-Trithiane is C3H6S3.
What is the molecular weight of 1,3,5-Trithiane?
The molecular weight of 1,3,5-Trithiane is 137.96317 g/mol.
What are the applications of 1,3,5-Trithiane?
1,3,5-Trithiane 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. CoreyChem supplies 1,3,5-Trithiane (CAS 291-21-4) with...
Where can I buy 1,3,5-Trithiane?
You can request a quote for 1,3,5-Trithiane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,3,5-Trithiane?
Yes, CoreyChem provides custom synthesis services for 1,3,5-Trithiane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.