3-(4-Fluorophenylthio)propanoic acid
TL;DR: 3-(4-Fluorophenylthio)propanoic acid (CAS 19543-85-2) is a chemical compound with molecular formula C9H9FO2S and molecular weight 200.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-fluorophenyl)sulfanylpropanoic acid
Also Known As: 3-(4-fluorophenylthio)propanoic acid, 3-(4-fluorophenylthio)propionic acid, 3-[(4-fluorophenyl)thio]propanoic acid, 3-[(4-fluorophenyl)sulfanyl]propanoic acid, 3-(4-fluorophenyl)sulfanylpropanoic Acid
| Molecular Formula | C9H9FO2S |
|---|---|
| Molecular Weight | 200.03 g/mol |
| LogP | 2.3925 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 200.03073 |
| Heavy Atoms | 13 |
| Complexity | 284.1711 |
Chemical Identifiers
| CAS Number | 19543-85-2 |
|---|---|
| SMILES | C1=CC(=CC=C1F)SCCC(=O)O |
Product Overview
3-(4-Fluorophenylthio)propanoic acid (CAS 19543-85-2), with molecular formula C9H9FO2S and molecular weight 200.03 g/mol. IUPAC: 3-(4-fluorophenyl)sulfanylpropanoic acid.
Chemical Property Profile of 3-(4-Fluorophenylthio)propanoic acid
Property Insights of 3-(4-Fluorophenylthio)propanoic acid
The XLogP value of 2.3925 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Fluorophenylthio)propanoic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 3-(4-Fluorophenylthio)propanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Fluorophenylthio)propanoic acid 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 3-(4-Fluorophenylthio)propanoic acid?
The CAS number of 3-(4-Fluorophenylthio)propanoic acid is 19543-85-2.
What is the molecular formula of 3-(4-Fluorophenylthio)propanoic acid?
The molecular formula of 3-(4-Fluorophenylthio)propanoic acid is C9H9FO2S.
What is the molecular weight of 3-(4-Fluorophenylthio)propanoic acid?
The molecular weight of 3-(4-Fluorophenylthio)propanoic acid is 200.03 g/mol.
Where can I buy 3-(4-Fluorophenylthio)propanoic acid?
You can request a quote for 3-(4-Fluorophenylthio)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Fluorophenylthio)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Fluorophenylthio)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.