Trifluoroethanethioamide
TL;DR: Trifluoroethanethioamide (CAS 421-52-3) is a chemical compound with molecular formula C2H2F3NS and molecular weight 128.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,2-trifluoroethanethioamide
Also Known As: 2,2,2-trifluoroethanethioamide, 2,2,2-Trifluorothioacetamide, trifluoroethanethioamide, trifluorothioacetamide, 2,2,2,-trifluorothioacetamide
| Molecular Formula | C2H2F3NS |
|---|---|
| Molecular Weight | 128.99 g/mol |
| LogP | 0.8348 |
| Topological Polar Surface Area | 26.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 128.98601 |
| Heavy Atoms | 7 |
| Complexity | 85.42592 |
Chemical Identifiers
| CAS Number | 421-52-3 |
|---|---|
| SMILES | C(=S)(C(F)(F)F)N |
Product Overview
Trifluoroethanethioamide (CAS 421-52-3), with molecular formula C2H2F3NS and molecular weight 128.99 g/mol. IUPAC: 2,2,2-trifluoroethanethioamide.
Chemical Property Profile of Trifluoroethanethioamide
Property Insights of Trifluoroethanethioamide
The XLogP value of 0.8348 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Trifluoroethanethioamide. With a topological polar surface area (TPSA) of 26.02 Ų, Trifluoroethanethioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Trifluoroethanethioamide has 1 hydrogen bond donor(s) and 1 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 Trifluoroethanethioamide?
The CAS number of Trifluoroethanethioamide is 421-52-3.
What is the molecular formula of Trifluoroethanethioamide?
The molecular formula of Trifluoroethanethioamide is C2H2F3NS.
What is the molecular weight of Trifluoroethanethioamide?
The molecular weight of Trifluoroethanethioamide is 128.99 g/mol.
Where can I buy Trifluoroethanethioamide?
You can request a quote for Trifluoroethanethioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trifluoroethanethioamide?
Yes, KEHONG BIO provides custom synthesis services for Trifluoroethanethioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.