2-(((4-Fluorophenyl)methyl)thio)ethanamine
TL;DR: 2-(((4-Fluorophenyl)methyl)thio)ethanamine (CAS 143627-49-0) is a chemical compound with molecular formula C9H12FNS and molecular weight 185.06744 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(4-fluorophenyl)methylsulfanyl]ethanamine
Also Known As: 2-(4-Fluorobenzylthio)ethylamine, 2-((4-Fluorobenzyl)thio)ethanamine, 2-[(4-fluorophenyl)methylsulfanyl]ethanamine, 2-((4-fluorobenzyl)thio)ethan-1-amine, 2-[(4-fluorobenzyl)sulfanyl]ethanamine
Technical Specifications
| Molecular Formula | C9H12FNS |
| Molecular Weight | 185.06744 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 51.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 185.06744 Da |
| Heavy Atoms | 12 |
| Complexity | 113.0 |
| SMILES | C1=CC(=CC=C1CSCCN)F |
| InChIKey | ZZZHOBZYZWMETL-UHFFFAOYSA-N |
Chemical Property Profile of 2-(((4-Fluorophenyl)methyl)thio)ethanamine
Property Insights of 2-(((4-Fluorophenyl)methyl)thio)ethanamine
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(((4-Fluorophenyl)methyl)thio)ethanamine. With a topological polar surface area (TPSA) of 51.3 Ų, 2-(((4-Fluorophenyl)methyl)thio)ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(((4-Fluorophenyl)methyl)thio)ethanamine has 1 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 2-(((4-Fluorophenyl)methyl)thio)ethanamine?
The CAS number of 2-(((4-Fluorophenyl)methyl)thio)ethanamine is 143627-49-0.
What is the molecular formula of 2-(((4-Fluorophenyl)methyl)thio)ethanamine?
The molecular formula of 2-(((4-Fluorophenyl)methyl)thio)ethanamine is C9H12FNS.
What is the molecular weight of 2-(((4-Fluorophenyl)methyl)thio)ethanamine?
The molecular weight of 2-(((4-Fluorophenyl)methyl)thio)ethanamine is 185.06744 g/mol.
Where can I buy 2-(((4-Fluorophenyl)methyl)thio)ethanamine?
You can request a quote for 2-(((4-Fluorophenyl)methyl)thio)ethanamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(((4-Fluorophenyl)methyl)thio)ethanamine?
Yes, CoreyChem provides custom synthesis services for 2-(((4-Fluorophenyl)methyl)thio)ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.