![2-{[(4-Fluorophenyl)methyl]sulfanyl}acetic acid structure](/static/products/6505/65051-24-3.webp)
2-{[(4-Fluorophenyl)methyl]sulfanyl}acetic acid
TL;DR: 2-{[(4-Fluorophenyl)methyl]sulfanyl}acetic acid (CAS 65051-24-3) 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.
2-[(4-fluorophenyl)methylsulfanyl]acetic acid
Also Known As: [(4-fluorobenzyl)thio]acetic acid|ChemDiv3_014329|p-Fluorobenzylthioacetic acid|2-{[(4-fluorophenyl)methyl]sulfanyl}acetic acid|[(4-fluorobenzyl)sulfanyl]acetic acid|(4-FLUOROBENZYL)THIO]ACETIC ACID|2-[(4-fluorophenyl)methylsulfanyl]acetic acid|2-((4-Fluorobenzyl)thio)acetic acid|2-((4-Fluorobenzyl)thio)aceticacid|7427AE|SP4202|(4-FLUOROBENZYL)THIO]ACETICACID|IDI1_030127|[(4-FLUOROBENZYL)THIO]ACETICACID|NCGC00339494-01|{[(4-fluorophenyl)methyl]sulfanyl}acetic acid|2-[(4-fluorophenyl)methylsulfanyl]acetate|2-[(4-fluorophenyl)methylthio]acetic acid|2-(((4-fluorophenyl)methyl)sulfanyl)acetic acid|2-[(4-FLUOROBENZYL)SULFANYL]ACETIC ACID|AB01332520-02|996-919-8
| Molecular Formula | C9H9FO2S |
|---|---|
| Molecular Weight | 200.03 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 62.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 200.03073 |
| Heavy Atoms | 13 |
| Complexity | 167.0 |
Chemical Identifiers
| CAS Number | 65051-24-3 |
|---|---|
| SMILES | C1=CC(=CC=C1CSCC(=O)O)F |
| InChIKey | ORCMGWGLMCFUIA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-{[(4-Fluorophenyl)methyl]sulfanyl}acetic acid (CAS 65051-24-3), with molecular formula C9H9FO2S and molecular weight 200.03 g/mol. IUPAC: 2-[(4-fluorophenyl)methylsulfanyl]acetic acid.
Chemical Property Profile of 2-{[(4-Fluorophenyl)methyl]sulfanyl}acetic acid
Property Insights of 2-{[(4-Fluorophenyl)methyl]sulfanyl}acetic acid
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{[(4-Fluorophenyl)methyl]sulfanyl}acetic acid. The TPSA of 62.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[(4-Fluorophenyl)methyl]sulfanyl}acetic acid. Following Lipinski's Rule of Five, 2-{[(4-Fluorophenyl)methyl]sulfanyl}acetic 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
Frequently Asked Questions
What is the CAS number of 2-{[(4-Fluorophenyl)methyl]sulfanyl}acetic acid?
The CAS number of 2-{[(4-Fluorophenyl)methyl]sulfanyl}acetic acid is 65051-24-3.
What is the molecular formula of 2-{[(4-Fluorophenyl)methyl]sulfanyl}acetic acid?
The molecular formula of 2-{[(4-Fluorophenyl)methyl]sulfanyl}acetic acid is C9H9FO2S.
What is the molecular weight of 2-{[(4-Fluorophenyl)methyl]sulfanyl}acetic acid?
The molecular weight of 2-{[(4-Fluorophenyl)methyl]sulfanyl}acetic acid is 200.03 g/mol.
Where can I buy 2-{[(4-Fluorophenyl)methyl]sulfanyl}acetic acid?
You can request a quote for 2-{[(4-Fluorophenyl)methyl]sulfanyl}acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[(4-Fluorophenyl)methyl]sulfanyl}acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-{[(4-Fluorophenyl)methyl]sulfanyl}acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.