![2-[(2,2-Diethoxyethyl)thio]-1,1,1-trifluoroethane structure](/static/products/851/85117-85-7.png)
2-[(2,2-Diethoxyethyl)thio]-1,1,1-trifluoroethane
TL;DR: 2-[(2,2-Diethoxyethyl)thio]-1,1,1-trifluoroethane (CAS 85117-85-7) is a chemical compound with molecular formula C8H15F3O2S and molecular weight 232.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,2-diethoxyethylsulfanyl)-1,1,1-trifluoroethane
Also Known As: EINECS 285-635-3, 2-[(2,2-DIETHOXYETHYL)THIO]-1,1,1-TRIFLUOROETHANE, 2-[ thio]-1,1,1-trifluoroethane, 2-((2,2-Diethoxyethyl)thio)-1,1,1-trifluoroethane, 2-(2,2-diethoxyethylsulfanyl)-1,1,1-trifluoroethane
| Molecular Formula | C8H15F3O2S |
|---|---|
| Molecular Weight | 232.07 g/mol |
| LogP | 2.681 |
| Topological Polar Surface Area | 18.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 232.07448 |
| Heavy Atoms | 14 |
| Complexity | 135.0383 |
Chemical Identifiers
| CAS Number | 85117-85-7 |
|---|---|
| SMILES | CCOC(CSCC(F)(F)F)OCC |
Product Overview
2-[(2,2-Diethoxyethyl)thio]-1,1,1-trifluoroethane (CAS 85117-85-7), with molecular formula C8H15F3O2S and molecular weight 232.07 g/mol. IUPAC: 2-(2,2-diethoxyethylsulfanyl)-1,1,1-trifluoroethane.
Chemical Property Profile of 2-[(2,2-Diethoxyethyl)thio]-1,1,1-trifluoroethane
Property Insights of 2-[(2,2-Diethoxyethyl)thio]-1,1,1-trifluoroethane
The XLogP value of 2.681 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(2,2-Diethoxyethyl)thio]-1,1,1-trifluoroethane. With a topological polar surface area (TPSA) of 18.46 Ų, 2-[(2,2-Diethoxyethyl)thio]-1,1,1-trifluoroethane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(2,2-Diethoxyethyl)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-Diethoxyethyl)thio]-1,1,1-trifluoroethane?
The CAS number of 2-[(2,2-Diethoxyethyl)thio]-1,1,1-trifluoroethane is 85117-85-7.
What is the molecular formula of 2-[(2,2-Diethoxyethyl)thio]-1,1,1-trifluoroethane?
The molecular formula of 2-[(2,2-Diethoxyethyl)thio]-1,1,1-trifluoroethane is C8H15F3O2S.
What is the molecular weight of 2-[(2,2-Diethoxyethyl)thio]-1,1,1-trifluoroethane?
The molecular weight of 2-[(2,2-Diethoxyethyl)thio]-1,1,1-trifluoroethane is 232.07 g/mol.
Where can I buy 2-[(2,2-Diethoxyethyl)thio]-1,1,1-trifluoroethane?
You can request a quote for 2-[(2,2-Diethoxyethyl)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-Diethoxyethyl)thio]-1,1,1-trifluoroethane?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2,2-Diethoxyethyl)thio]-1,1,1-trifluoroethane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.