2-((2,2-Dimethoxyethyl)thio)-1,1,1-trifluoroethane
TL;DR: 2-((2,2-Dimethoxyethyl)thio)-1,1,1-trifluoroethane (CAS 84455-36-7) is a chemical compound with molecular formula C6H11F3O2S and molecular weight 204.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,2-dimethoxyethylsulfanyl)-1,1,1-trifluoroethane
Also Known As: EINECS 282-898-6, 2-[(2,2-DIMETHOXYETHYL)THIO]-1,1,1-TRIFLUOROETHANE, 2-((2,2-Dimethoxyethyl)thio)-1,1,1-trifluoroethane, 2-(2,2-dimethoxyethylsulfanyl)-1,1,1-trifluoroethane, 2,2,2-Trifluoroethylmercaptoacetaldehyde Dimethylacetal
| Molecular Formula | C6H11F3O2S |
|---|---|
| Molecular Weight | 204.04 g/mol |
| LogP | 1.9008 |
| Topological Polar Surface Area | 18.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 204.04318 |
| Heavy Atoms | 12 |
| Complexity | 113.85105 |
Chemical Identifiers
| CAS Number | 84455-36-7 |
|---|---|
| SMILES | COC(CSCC(F)(F)F)OC |
Product Overview
2-((2,2-Dimethoxyethyl)thio)-1,1,1-trifluoroethane (CAS 84455-36-7), with molecular formula C6H11F3O2S and molecular weight 204.04 g/mol. IUPAC: 2-(2,2-dimethoxyethylsulfanyl)-1,1,1-trifluoroethane.
Chemical Property Profile of 2-((2,2-Dimethoxyethyl)thio)-1,1,1-trifluoroethane
Property Insights of 2-((2,2-Dimethoxyethyl)thio)-1,1,1-trifluoroethane
The XLogP value of 1.9008 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((2,2-Dimethoxyethyl)thio)-1,1,1-trifluoroethane. With a topological polar surface area (TPSA) of 18.46 Ų, 2-((2,2-Dimethoxyethyl)thio)-1,1,1-trifluoroethane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((2,2-Dimethoxyethyl)thio)-1,1,1-trifluoroethane 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
Frequently Asked Questions
What is the CAS number of 2-((2,2-Dimethoxyethyl)thio)-1,1,1-trifluoroethane?
The CAS number of 2-((2,2-Dimethoxyethyl)thio)-1,1,1-trifluoroethane is 84455-36-7.
What is the molecular formula of 2-((2,2-Dimethoxyethyl)thio)-1,1,1-trifluoroethane?
The molecular formula of 2-((2,2-Dimethoxyethyl)thio)-1,1,1-trifluoroethane is C6H11F3O2S.
What is the molecular weight of 2-((2,2-Dimethoxyethyl)thio)-1,1,1-trifluoroethane?
The molecular weight of 2-((2,2-Dimethoxyethyl)thio)-1,1,1-trifluoroethane is 204.04 g/mol.
Where can I buy 2-((2,2-Dimethoxyethyl)thio)-1,1,1-trifluoroethane?
You can request a quote for 2-((2,2-Dimethoxyethyl)thio)-1,1,1-trifluoroethane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((2,2-Dimethoxyethyl)thio)-1,1,1-trifluoroethane?
Yes, KEHONG BIO provides custom synthesis services for 2-((2,2-Dimethoxyethyl)thio)-1,1,1-trifluoroethane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.