![2-[(4-Fluorophenyl)methylthio]propanoic acid structure](/static/products/1223/122305-67-3.webp)
2-[(4-Fluorophenyl)methylthio]propanoic acid
TL;DR: 2-[(4-Fluorophenyl)methylthio]propanoic acid (CAS 122305-67-3) is a chemical compound with molecular formula C10H11FO2S and molecular weight 214.04637 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(4-fluorophenyl)methylsulfanyl]propanoic acid
Also Known As: 2-[[(4-Fluorophenyl)methyl]thio]propanoic acid, 2-[(4-fluorophenyl)methylsulfanyl]propanoic Acid, 2-[(4-fluorophenyl)methylthio]propanoic acid, 2-{[(4-FLUOROPHENYL)METHYL]SULFANYL}PROPANOIC ACID
Technical Specifications
| Molecular Formula | C10H11FO2S |
| Molecular Weight | 214.04637 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 62.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 214.04637 Da |
| Heavy Atoms | 14 |
| Complexity | 191.0 |
| SMILES | CC(C(=O)O)SCC1=CC=C(C=C1)F |
| InChIKey | JNYRAMJQLUPMSH-UHFFFAOYSA-N |
Chemical Property Profile of 2-[(4-Fluorophenyl)methylthio]propanoic acid
Property Insights of 2-[(4-Fluorophenyl)methylthio]propanoic acid
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(4-Fluorophenyl)methylthio]propanoic acid. The TPSA of 62.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(4-Fluorophenyl)methylthio]propanoic acid. Following Lipinski's Rule of Five, 2-[(4-Fluorophenyl)methylthio]propanoic acid has 1 hydrogen bond donor(s) and 4 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)methylthio]propanoic acid?
The CAS number of 2-[(4-Fluorophenyl)methylthio]propanoic acid is 122305-67-3.
What is the molecular formula of 2-[(4-Fluorophenyl)methylthio]propanoic acid?
The molecular formula of 2-[(4-Fluorophenyl)methylthio]propanoic acid is C10H11FO2S.
What is the molecular weight of 2-[(4-Fluorophenyl)methylthio]propanoic acid?
The molecular weight of 2-[(4-Fluorophenyl)methylthio]propanoic acid is 214.04637 g/mol.
Where can I buy 2-[(4-Fluorophenyl)methylthio]propanoic acid?
You can request a quote for 2-[(4-Fluorophenyl)methylthio]propanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-[(4-Fluorophenyl)methylthio]propanoic acid?
Yes, CoreyChem provides custom synthesis services for 2-[(4-Fluorophenyl)methylthio]propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.