Trifluoromethanethiol
TL;DR: Trifluoromethanethiol (CAS 1493-15-8) is a chemical compound with molecular formula CHF3S and molecular weight 101.975105 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
trifluoromethanethiol
Also Known As: Trifluoromethanethiol, Perfluoromethanethiol, Methanethiol, trifluoro-, trifluoromethylthiol, Trifluoromethylmercaptan
Application Areas
Top 5 of 20 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | CHF3S |
| Molecular Weight | 101.975105 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 1.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 101.975105 Da |
| Heavy Atoms | 5 |
| Complexity | 28.0 |
| SMILES | C(F)(F)(F)S |
| InChIKey | MFLLMKMFWIUACU-UHFFFAOYSA-N |
Product Description
Applications: Trifluoromethanethiol is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Trifluoromethanethiol (CAS 1493-15-8) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Trifluoromethanethiol is a heterocyclic building block identified by CAS number 1493-15-8 and the molecular formula CHF3S and a molecular weight of 101.98 g/mol. It is also known as Trifluoromethanethiol and Perfluoromethanethiol.
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 Trifluoromethanethiol
Property Insights of Trifluoromethanethiol
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Trifluoromethanethiol. With a topological polar surface area (TPSA) of 1.0 Ų, Trifluoromethanethiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Trifluoromethanethiol has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Trifluoromethanethiol?
The CAS number of Trifluoromethanethiol is 1493-15-8.
What is the molecular formula of Trifluoromethanethiol?
The molecular formula of Trifluoromethanethiol is CHF3S.
What is the molecular weight of Trifluoromethanethiol?
The molecular weight of Trifluoromethanethiol is 101.975105 g/mol.
What are the applications of Trifluoromethanethiol?
Trifluoromethanethiol is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Trifluoromethanethiol (CAS...
Where can I buy Trifluoromethanethiol?
You can request a quote for Trifluoromethanethiol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Trifluoromethanethiol?
Yes, CoreyChem provides custom synthesis services for Trifluoromethanethiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.