![3-[(4-Fluorobenzyl)thio]propanoic acid structure](/static/products/2391/23912-15-4.webp)
3-[(4-Fluorobenzyl)thio]propanoic acid
TL;DR: 3-[(4-Fluorobenzyl)thio]propanoic acid (CAS 23912-15-4) is a chemical compound with molecular formula C10H11FO2S and molecular weight 214.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-fluorophenyl)methylsulfanyl]propanoic acid
Also Known As: 3-[(4-FLUOROBENZYL)THIO]PROPANOIC ACID, 3-[(4-fluorophenyl)methylsulfanyl]propanoic Acid, 3-((4-Fluorobenzyl)thio)propanoic acid, 3-((4-Fluorobenzyl)thio)propanoicacid, 3-[(4-Fluorobenzyl)thio]propanoicacid
| Molecular Formula | C10H11FO2S |
|---|---|
| Molecular Weight | 214.05 g/mol |
| LogP | 2.5336 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 214.04637 |
| Heavy Atoms | 14 |
| Complexity | 297.49524 |
Chemical Identifiers
| CAS Number | 23912-15-4 |
|---|---|
| SMILES | C1=CC(=CC=C1CSCCC(=O)O)F |
Product Overview
3-[(4-Fluorobenzyl)thio]propanoic acid (CAS 23912-15-4), with molecular formula C10H11FO2S and molecular weight 214.05 g/mol. IUPAC: 3-[(4-fluorophenyl)methylsulfanyl]propanoic acid.
Chemical Property Profile of 3-[(4-Fluorobenzyl)thio]propanoic acid
Property Insights of 3-[(4-Fluorobenzyl)thio]propanoic acid
The XLogP value of 2.5336 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(4-Fluorobenzyl)thio]propanoic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 3-[(4-Fluorobenzyl)thio]propanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(4-Fluorobenzyl)thio]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-Fluorobenzyl)thio]propanoic acid?
The CAS number of 3-[(4-Fluorobenzyl)thio]propanoic acid is 23912-15-4.
What is the molecular formula of 3-[(4-Fluorobenzyl)thio]propanoic acid?
The molecular formula of 3-[(4-Fluorobenzyl)thio]propanoic acid is C10H11FO2S.
What is the molecular weight of 3-[(4-Fluorobenzyl)thio]propanoic acid?
The molecular weight of 3-[(4-Fluorobenzyl)thio]propanoic acid is 214.05 g/mol.
Where can I buy 3-[(4-Fluorobenzyl)thio]propanoic acid?
You can request a quote for 3-[(4-Fluorobenzyl)thio]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-Fluorobenzyl)thio]propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[(4-Fluorobenzyl)thio]propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.