3,3-Diethoxy-2-(trifluoromethyl)thietane 1,1-dioxide
TL;DR: 3,3-Diethoxy-2-(trifluoromethyl)thietane 1,1-dioxide (CAS 834-62-8) is a chemical compound with molecular formula C8H13F3O4S and molecular weight 262.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-diethoxy-2-(trifluoromethyl)thietane 1,1-dioxide
Also Known As: 3,3-diethoxy-2-(trifluoromethyl)thietane 1,1-dioxide, 3,3-Diethoxy-2-(trifluoromethyl)-1lambda~6~-thietane-1,1-dione, RefChem:270237
| Molecular Formula | C8H13F3O4S |
|---|---|
| Molecular Weight | 262.05 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 61.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 262.04868 |
| Heavy Atoms | 16 |
| Complexity | 337.0 |
Chemical Identifiers
| CAS Number | 834-62-8 |
|---|---|
| SMILES | CCOC1(CS(=O)(=O)C1C(F)(F)F)OCC |
| InChIKey | PFLZVCODKRHZPY-UHFFFAOYSA-N |
Product Overview
3,3-Diethoxy-2-(trifluoromethyl)thietane 1,1-dioxide (CAS 834-62-8), with molecular formula C8H13F3O4S and molecular weight 262.05 g/mol. IUPAC: 3,3-diethoxy-2-(trifluoromethyl)thietane 1,1-dioxide.
Chemical Property Profile of 3,3-Diethoxy-2-(trifluoromethyl)thietane 1,1-dioxide
Property Insights of 3,3-Diethoxy-2-(trifluoromethyl)thietane 1,1-dioxide
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3-Diethoxy-2-(trifluoromethyl)thietane 1,1-dioxide. The TPSA of 61.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3-Diethoxy-2-(trifluoromethyl)thietane 1,1-dioxide. Following Lipinski's Rule of Five, 3,3-Diethoxy-2-(trifluoromethyl)thietane 1,1-dioxide has 0 hydrogen bond donor(s) and 7 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 3,3-Diethoxy-2-(trifluoromethyl)thietane 1,1-dioxide?
The CAS number of 3,3-Diethoxy-2-(trifluoromethyl)thietane 1,1-dioxide is 834-62-8.
What is the molecular formula of 3,3-Diethoxy-2-(trifluoromethyl)thietane 1,1-dioxide?
The molecular formula of 3,3-Diethoxy-2-(trifluoromethyl)thietane 1,1-dioxide is C8H13F3O4S.
What is the molecular weight of 3,3-Diethoxy-2-(trifluoromethyl)thietane 1,1-dioxide?
The molecular weight of 3,3-Diethoxy-2-(trifluoromethyl)thietane 1,1-dioxide is 262.05 g/mol.
Where can I buy 3,3-Diethoxy-2-(trifluoromethyl)thietane 1,1-dioxide?
You can request a quote for 3,3-Diethoxy-2-(trifluoromethyl)thietane 1,1-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-Diethoxy-2-(trifluoromethyl)thietane 1,1-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 3,3-Diethoxy-2-(trifluoromethyl)thietane 1,1-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.