Ethyl 2,3,5,6-tetrafluoro-4-methylsulfanylbenzoate
TL;DR: Ethyl 2,3,5,6-tetrafluoro-4-methylsulfanylbenzoate (CAS 244766-57-2) is a chemical compound with molecular formula C10H8F4O2S and molecular weight 268.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2,3,5,6-tetrafluoro-4-methylsulfanylbenzoate
Also Known As: ethyl 2,3,5,6-tetrafluoro-4-methylsulfanylbenzoate, ethyl 2,3,5,6-tetrafluoro-4-(methylthio)benzoate, Ethyl 2,3,5,6-tetrafluoro-4-(methylsulfanyl)benzoate
| Molecular Formula | C10H8F4O2S |
|---|---|
| Molecular Weight | 268.02 g/mol |
| LogP | 3.1416 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 268.01813 |
| Heavy Atoms | 17 |
| Complexity | 433.1045 |
Chemical Identifiers
| CAS Number | 244766-57-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(C(=C(C(=C1F)F)SC)F)F |
Product Overview
Ethyl 2,3,5,6-tetrafluoro-4-methylsulfanylbenzoate (CAS 244766-57-2), with molecular formula C10H8F4O2S and molecular weight 268.02 g/mol. IUPAC: ethyl 2,3,5,6-tetrafluoro-4-methylsulfanylbenzoate.
Chemical Property Profile of Ethyl 2,3,5,6-tetrafluoro-4-methylsulfanylbenzoate
Property Insights of Ethyl 2,3,5,6-tetrafluoro-4-methylsulfanylbenzoate
The XLogP value of 3.1416 indicates that Ethyl 2,3,5,6-tetrafluoro-4-methylsulfanylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Ethyl 2,3,5,6-tetrafluoro-4-methylsulfanylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2,3,5,6-tetrafluoro-4-methylsulfanylbenzoate 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 Ethyl 2,3,5,6-tetrafluoro-4-methylsulfanylbenzoate?
The CAS number of Ethyl 2,3,5,6-tetrafluoro-4-methylsulfanylbenzoate is 244766-57-2.
What is the molecular formula of Ethyl 2,3,5,6-tetrafluoro-4-methylsulfanylbenzoate?
The molecular formula of Ethyl 2,3,5,6-tetrafluoro-4-methylsulfanylbenzoate is C10H8F4O2S.
What is the molecular weight of Ethyl 2,3,5,6-tetrafluoro-4-methylsulfanylbenzoate?
The molecular weight of Ethyl 2,3,5,6-tetrafluoro-4-methylsulfanylbenzoate is 268.02 g/mol.
Where can I buy Ethyl 2,3,5,6-tetrafluoro-4-methylsulfanylbenzoate?
You can request a quote for Ethyl 2,3,5,6-tetrafluoro-4-methylsulfanylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2,3,5,6-tetrafluoro-4-methylsulfanylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2,3,5,6-tetrafluoro-4-methylsulfanylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.