![6-Ethyl-3-trifluoromethyl-2,3-dihydro-benzo[1,4]oxathiine 4,4-dioxide structure](/static/products/339/339349-46-1.png)
6-Ethyl-3-trifluoromethyl-2,3-dihydro-benzo[1,4]oxathiine 4,4-dioxide
TL;DR: 6-Ethyl-3-trifluoromethyl-2,3-dihydro-benzo[1,4]oxathiine 4,4-dioxide (CAS 339349-46-1) is a chemical compound with molecular formula C11H11F3O3S and molecular weight 280.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-ethyl-3-(trifluoromethyl)-2,3-dihydro-1,4λ6-benzoxathiine 4,4-dioxide
Also Known As: TimTec1_003871, 6-ethyl-3-(trifluoromethyl)-2,3-dihydro-1,4, 6-Ethyl-3-trifluoromethyl-2,3-dihydro-benzo[1,4]oxathiine 4,4-dioxide, 1,4-benzoxathiin, 6-ethyl-2,3-dihydro-3-(trifluoromethyl)-, 4,4-dioxide, 6-Ethyl-3-(trifluoromethyl)-2,3-dihydro-1,4-benzoxathiine 4,4-dioxide
| Molecular Formula | C11H11F3O3S |
|---|---|
| Molecular Weight | 280.04 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 280.0381 |
| Heavy Atoms | 18 |
| Complexity | 399.0 |
Chemical Identifiers
| CAS Number | 339349-46-1 |
|---|---|
| SMILES | CCC1=CC2=C(C=C1)OCC(S2(=O)=O)C(F)(F)F |
| InChIKey | TUKAQDSFFFWSRA-UHFFFAOYSA-N |
Product Overview
6-Ethyl-3-trifluoromethyl-2,3-dihydro-benzo[1,4]oxathiine 4,4-dioxide (CAS 339349-46-1), with molecular formula C11H11F3O3S and molecular weight 280.04 g/mol. IUPAC: 6-ethyl-3-(trifluoromethyl)-2,3-dihydro-1,4λ6-benzoxathiine 4,4-dioxide.
Chemical Property Profile of 6-Ethyl-3-trifluoromethyl-2,3-dihydro-benzo[1,4]oxathiine 4,4-dioxide
Property Insights of 6-Ethyl-3-trifluoromethyl-2,3-dihydro-benzo[1,4]oxathiine 4,4-dioxide
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Ethyl-3-trifluoromethyl-2,3-dihydro-benzo[1,4]oxathiine 4,4-dioxide. With a topological polar surface area (TPSA) of 51.8 Ų, 6-Ethyl-3-trifluoromethyl-2,3-dihydro-benzo[1,4]oxathiine 4,4-dioxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Ethyl-3-trifluoromethyl-2,3-dihydro-benzo[1,4]oxathiine 4,4-dioxide has 0 hydrogen bond donor(s) and 6 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 6-Ethyl-3-trifluoromethyl-2,3-dihydro-benzo[1,4]oxathiine 4,4-dioxide?
The CAS number of 6-Ethyl-3-trifluoromethyl-2,3-dihydro-benzo[1,4]oxathiine 4,4-dioxide is 339349-46-1.
What is the molecular formula of 6-Ethyl-3-trifluoromethyl-2,3-dihydro-benzo[1,4]oxathiine 4,4-dioxide?
The molecular formula of 6-Ethyl-3-trifluoromethyl-2,3-dihydro-benzo[1,4]oxathiine 4,4-dioxide is C11H11F3O3S.
What is the molecular weight of 6-Ethyl-3-trifluoromethyl-2,3-dihydro-benzo[1,4]oxathiine 4,4-dioxide?
The molecular weight of 6-Ethyl-3-trifluoromethyl-2,3-dihydro-benzo[1,4]oxathiine 4,4-dioxide is 280.04 g/mol.
Where can I buy 6-Ethyl-3-trifluoromethyl-2,3-dihydro-benzo[1,4]oxathiine 4,4-dioxide?
You can request a quote for 6-Ethyl-3-trifluoromethyl-2,3-dihydro-benzo[1,4]oxathiine 4,4-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Ethyl-3-trifluoromethyl-2,3-dihydro-benzo[1,4]oxathiine 4,4-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 6-Ethyl-3-trifluoromethyl-2,3-dihydro-benzo[1,4]oxathiine 4,4-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.