3-(4-Fluoro-phenyl)-2-thiophen-2-yl-acrylic acid
TL;DR: 3-(4-Fluoro-phenyl)-2-thiophen-2-yl-acrylic acid (CAS 104314-04-7) is a chemical compound with molecular formula C13H9FO2S and molecular weight 248.03073 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(Z)-3-(4-fluorophenyl)-2-thiophen-2-ylprop-2-enoic acid
Also Known As: 3-(4-Fluoro-phenyl)-2-thiophen-2-yl-acrylic acid, 2-Aminopyridine-3-carbaldehydeoximehydrochloride, 3-(4-Fluorophenyl)-2-(thiophen-2-yl)acrylicacid, 3-(4-fluorophenyl)-2-(thiophen-2-yl)prop-2-enoic acid, 3-(4-Fluorophenyl)-2-(thiophen-2-yl)acrylic acid
Technical Specifications
| Molecular Formula | C13H9FO2S |
| Molecular Weight | 248.03073 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 65.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 248.03073 Da |
| Heavy Atoms | 17 |
| Complexity | 309.0 |
| SMILES | C1=CSC(=C1)/C(=C\C2=CC=C(C=C2)F)/C(=O)O |
| InChIKey | SSDFXAHSMOGNIW-DHZHZOJOSA-N |
Chemical Property Profile of 3-(4-Fluoro-phenyl)-2-thiophen-2-yl-acrylic acid
Property Insights of 3-(4-Fluoro-phenyl)-2-thiophen-2-yl-acrylic acid
The XLogP value of 3.3 indicates that 3-(4-Fluoro-phenyl)-2-thiophen-2-yl-acrylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Fluoro-phenyl)-2-thiophen-2-yl-acrylic acid. Following Lipinski's Rule of Five, 3-(4-Fluoro-phenyl)-2-thiophen-2-yl-acrylic 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 3-(4-Fluoro-phenyl)-2-thiophen-2-yl-acrylic acid?
The CAS number of 3-(4-Fluoro-phenyl)-2-thiophen-2-yl-acrylic acid is 104314-04-7.
What is the molecular formula of 3-(4-Fluoro-phenyl)-2-thiophen-2-yl-acrylic acid?
The molecular formula of 3-(4-Fluoro-phenyl)-2-thiophen-2-yl-acrylic acid is C13H9FO2S.
What is the molecular weight of 3-(4-Fluoro-phenyl)-2-thiophen-2-yl-acrylic acid?
The molecular weight of 3-(4-Fluoro-phenyl)-2-thiophen-2-yl-acrylic acid is 248.03073 g/mol.
Where can I buy 3-(4-Fluoro-phenyl)-2-thiophen-2-yl-acrylic acid?
You can request a quote for 3-(4-Fluoro-phenyl)-2-thiophen-2-yl-acrylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(4-Fluoro-phenyl)-2-thiophen-2-yl-acrylic acid?
Yes, CoreyChem provides custom synthesis services for 3-(4-Fluoro-phenyl)-2-thiophen-2-yl-acrylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.