1-(2-Phenoxyethylsulfanyl)-3-(trifluoromethyl)benzene
TL;DR: 1-(2-Phenoxyethylsulfanyl)-3-(trifluoromethyl)benzene (CAS 338792-27-1) is a chemical compound with molecular formula C15H13F3OS and molecular weight 298.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-phenoxyethylsulfanyl)-3-(trifluoromethyl)benzene
Also Known As: 6G-397S, 1-(2-phenoxyethylsulfanyl)-3-(trifluoromethyl)benzene, 1-[(2-phenoxyethyl)sulfanyl]-3-(trifluoromethyl)benzene, phenyl 2-{[3-(trifluoromethyl)phenyl]sulfanyl}ethyl ether
| Molecular Formula | C15H13F3OS |
|---|---|
| Molecular Weight | 298.06 g/mol |
| LogP | 4.8765 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 298.06393 |
| Heavy Atoms | 20 |
| Complexity | 540.31494 |
Chemical Identifiers
| CAS Number | 338792-27-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)OCCSC2=CC=CC(=C2)C(F)(F)F |
Product Overview
1-(2-Phenoxyethylsulfanyl)-3-(trifluoromethyl)benzene (CAS 338792-27-1), with molecular formula C15H13F3OS and molecular weight 298.06 g/mol. IUPAC: 1-(2-phenoxyethylsulfanyl)-3-(trifluoromethyl)benzene.
Chemical Property Profile of 1-(2-Phenoxyethylsulfanyl)-3-(trifluoromethyl)benzene
Property Insights of 1-(2-Phenoxyethylsulfanyl)-3-(trifluoromethyl)benzene
The XLogP value of 4.8765 indicates that 1-(2-Phenoxyethylsulfanyl)-3-(trifluoromethyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, 1-(2-Phenoxyethylsulfanyl)-3-(trifluoromethyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Phenoxyethylsulfanyl)-3-(trifluoromethyl)benzene has 0 hydrogen bond donor(s) and 2 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 1-(2-Phenoxyethylsulfanyl)-3-(trifluoromethyl)benzene?
The CAS number of 1-(2-Phenoxyethylsulfanyl)-3-(trifluoromethyl)benzene is 338792-27-1.
What is the molecular formula of 1-(2-Phenoxyethylsulfanyl)-3-(trifluoromethyl)benzene?
The molecular formula of 1-(2-Phenoxyethylsulfanyl)-3-(trifluoromethyl)benzene is C15H13F3OS.
What is the molecular weight of 1-(2-Phenoxyethylsulfanyl)-3-(trifluoromethyl)benzene?
The molecular weight of 1-(2-Phenoxyethylsulfanyl)-3-(trifluoromethyl)benzene is 298.06 g/mol.
Where can I buy 1-(2-Phenoxyethylsulfanyl)-3-(trifluoromethyl)benzene?
You can request a quote for 1-(2-Phenoxyethylsulfanyl)-3-(trifluoromethyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Phenoxyethylsulfanyl)-3-(trifluoromethyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Phenoxyethylsulfanyl)-3-(trifluoromethyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.