2-Fluorothiophenol
TL;DR: 2-Fluorothiophenol (CAS 2557-78-0) is a chemical compound with molecular formula C6H5FS and molecular weight 128.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-fluorobenzenethiol
Also Known As: 2-Fluorothiophenol, 2-Fluorobenzenethiol, o-Fluorothiophenol, o-fluorobenzenethiol, fluorothiophenol
| Molecular Formula | C6H5FS |
|---|---|
| Molecular Weight | 128.01 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 1.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 128.0096 |
| Heavy Atoms | 8 |
| Complexity | 74.0 |
Chemical Identifiers
| CAS Number | 2557-78-0 |
|---|---|
| SMILES | C1=CC=C(C(=C1)F)S |
| InChIKey | WJTZZPVVTSDNJJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Fluorothiophenol (CAS 2557-78-0), with molecular formula C6H5FS and molecular weight 128.01 g/mol. IUPAC: 2-fluorobenzenethiol.
Chemical Property Profile of 2-Fluorothiophenol
Property Insights of 2-Fluorothiophenol
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Fluorothiophenol. With a topological polar surface area (TPSA) of 1.0 Ų, 2-Fluorothiophenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Fluorothiophenol has 1 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 2-Fluorothiophenol?
The CAS number of 2-Fluorothiophenol is 2557-78-0.
What is the molecular formula of 2-Fluorothiophenol?
The molecular formula of 2-Fluorothiophenol is C6H5FS.
What is the molecular weight of 2-Fluorothiophenol?
The molecular weight of 2-Fluorothiophenol is 128.01 g/mol.
Where can I buy 2-Fluorothiophenol?
You can request a quote for 2-Fluorothiophenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Fluorothiophenol?
Yes, KEHONG BIO provides custom synthesis services for 2-Fluorothiophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.