1-(4-Fluorophenyl)-2-(phenylsulfanyl)ethan-1-one
TL;DR: 1-(4-Fluorophenyl)-2-(phenylsulfanyl)ethan-1-one (CAS 107820-47-3) is a chemical compound with molecular formula C14H11FOS and molecular weight 246.05147 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-fluorophenyl)-2-phenylsulfanylethanone
Also Known As: 1-(4-fluorophenyl)-2-(phenylsulfanyl)ethan-1-one, 1-(4-fluorophenyl)-2-(phenylthio)ethanone, 1-(4-fluorophenyl)-2-phenylsulfanylethanone, 1-(4-fluorophenyl)-2-(phenylsulfanyl)ethanone
Technical Specifications
| Molecular Formula | C14H11FOS |
| Molecular Weight | 246.05147 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 42.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 246.05147 Da |
| Heavy Atoms | 17 |
| Complexity | 243.0 |
| SMILES | C1=CC=C(C=C1)SCC(=O)C2=CC=C(C=C2)F |
| InChIKey | OAQNFHLYQUKIJE-UHFFFAOYSA-N |
Chemical Property Profile of 1-(4-Fluorophenyl)-2-(phenylsulfanyl)ethan-1-one
Property Insights of 1-(4-Fluorophenyl)-2-(phenylsulfanyl)ethan-1-one
The XLogP value of 3.9 indicates that 1-(4-Fluorophenyl)-2-(phenylsulfanyl)ethan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.4 Ų, 1-(4-Fluorophenyl)-2-(phenylsulfanyl)ethan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Fluorophenyl)-2-(phenylsulfanyl)ethan-1-one 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
What is the CAS number of 1-(4-Fluorophenyl)-2-(phenylsulfanyl)ethan-1-one?
The CAS number of 1-(4-Fluorophenyl)-2-(phenylsulfanyl)ethan-1-one is 107820-47-3.
What is the molecular formula of 1-(4-Fluorophenyl)-2-(phenylsulfanyl)ethan-1-one?
The molecular formula of 1-(4-Fluorophenyl)-2-(phenylsulfanyl)ethan-1-one is C14H11FOS.
What is the molecular weight of 1-(4-Fluorophenyl)-2-(phenylsulfanyl)ethan-1-one?
The molecular weight of 1-(4-Fluorophenyl)-2-(phenylsulfanyl)ethan-1-one is 246.05147 g/mol.
Where can I buy 1-(4-Fluorophenyl)-2-(phenylsulfanyl)ethan-1-one?
You can request a quote for 1-(4-Fluorophenyl)-2-(phenylsulfanyl)ethan-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(4-Fluorophenyl)-2-(phenylsulfanyl)ethan-1-one?
Yes, CoreyChem provides custom synthesis services for 1-(4-Fluorophenyl)-2-(phenylsulfanyl)ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.