2-((2-Chloro-1,1,2-trifluoroethyl)thio)-2-methylpropane
TL;DR: 2-((2-Chloro-1,1,2-trifluoroethyl)thio)-2-methylpropane (CAS 111959-97-8) is a chemical compound with molecular formula C6H10ClF3S and molecular weight 206.01439 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-chloro-1,1,2-trifluoroethyl)sulfanyl-2-methylpropane
Also Known As: 2-((2-Chloro-1,1,2-trifluoroethyl)thio)-2-methylpropane, Propane, 2-((2-chloro-1,1,2-trifluoroethyl)thio)-2-methyl-, 2-(2-chloro-1,1,2-trifluoroethyl)sulfanyl-2-methylpropane, 2-[(2-CHLORO-1,1,2-TRIFLUOROETHYL)SULFANYL]-2-METHYLPROPANE
Technical Specifications
| Molecular Formula | C6H10ClF3S |
| Molecular Weight | 206.01439 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 206.01439 Da |
| Heavy Atoms | 11 |
| Complexity | 132.0 |
| SMILES | CC(C)(C)SC(C(F)Cl)(F)F |
| InChIKey | PYMCLNCVVVTINB-UHFFFAOYSA-N |
Chemical Property Profile of 2-((2-Chloro-1,1,2-trifluoroethyl)thio)-2-methylpropane
Property Insights of 2-((2-Chloro-1,1,2-trifluoroethyl)thio)-2-methylpropane
The XLogP value of 3.7 indicates that 2-((2-Chloro-1,1,2-trifluoroethyl)thio)-2-methylpropane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.3 Ų, 2-((2-Chloro-1,1,2-trifluoroethyl)thio)-2-methylpropane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((2-Chloro-1,1,2-trifluoroethyl)thio)-2-methylpropane has 0 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 2-((2-Chloro-1,1,2-trifluoroethyl)thio)-2-methylpropane?
The CAS number of 2-((2-Chloro-1,1,2-trifluoroethyl)thio)-2-methylpropane is 111959-97-8.
What is the molecular formula of 2-((2-Chloro-1,1,2-trifluoroethyl)thio)-2-methylpropane?
The molecular formula of 2-((2-Chloro-1,1,2-trifluoroethyl)thio)-2-methylpropane is C6H10ClF3S.
What is the molecular weight of 2-((2-Chloro-1,1,2-trifluoroethyl)thio)-2-methylpropane?
The molecular weight of 2-((2-Chloro-1,1,2-trifluoroethyl)thio)-2-methylpropane is 206.01439 g/mol.
Where can I buy 2-((2-Chloro-1,1,2-trifluoroethyl)thio)-2-methylpropane?
You can request a quote for 2-((2-Chloro-1,1,2-trifluoroethyl)thio)-2-methylpropane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-((2-Chloro-1,1,2-trifluoroethyl)thio)-2-methylpropane?
Yes, CoreyChem provides custom synthesis services for 2-((2-Chloro-1,1,2-trifluoroethyl)thio)-2-methylpropane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.