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 248.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(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
| Molecular Formula | C13H9FO2S |
|---|---|
| Molecular Weight | 248.03 g/mol |
| LogP | 3.5124 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 248.03073 |
| Heavy Atoms | 17 |
| Complexity | 541.3082 |
Chemical Identifiers
| CAS Number | 104314-04-7 |
|---|---|
| SMILES | C1=CSC(=C1)/C(=C\C2=CC=C(C=C2)F)/C(=O)O |
Product Overview
3-(4-Fluoro-phenyl)-2-thiophen-2-yl-acrylic acid (CAS 104314-04-7), with molecular formula C13H9FO2S and molecular weight 248.03 g/mol. IUPAC: (Z)-3-(4-fluorophenyl)-2-thiophen-2-ylprop-2-enoic acid.
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 3.5124 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. With a topological polar surface area (TPSA) of 37.3 Ų, 3-(4-Fluoro-phenyl)-2-thiophen-2-yl-acrylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Fluoro-phenyl)-2-thiophen-2-yl-acrylic 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-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 248.03 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 KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Fluoro-phenyl)-2-thiophen-2-yl-acrylic acid?
Yes, KEHONG BIO 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.