![(E)-3-[5-fluoro-2-(trifluoromethyl)phenyl]prop-2-enoic acid structure](/static/products/1184/1184721-90-1.webp)
(E)-3-[5-fluoro-2-(trifluoromethyl)phenyl]prop-2-enoic acid
TL;DR: (E)-3-[5-fluoro-2-(trifluoromethyl)phenyl]prop-2-enoic acid (CAS 1184721-90-1) is a chemical compound with molecular formula C10H6F4O2 and molecular weight 234.0304 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[5-fluoro-2-(trifluoromethyl)phenyl]prop-2-enoic acid
Also Known As: 5-Fluoro-2-(trifluoromethyl)cinnamic acid, (E)-3-[5-fluoro-2-(trifluoromethyl)phenyl]prop-2-enoic acid, 3-[5-fluoro-2-(trifluoromethyl)phenyl]prop-2-enoic Acid
Technical Specifications
| Molecular Formula | C10H6F4O2 |
| Molecular Weight | 234.0304 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 234.0304 Da |
| Heavy Atoms | 16 |
| Complexity | 285.0 |
| SMILES | C1=CC(=C(C=C1F)C=CC(=O)O)C(F)(F)F |
| InChIKey | LGTHHQOWFLXKQU-UHFFFAOYSA-N |
Chemical Property Profile of (E)-3-[5-fluoro-2-(trifluoromethyl)phenyl]prop-2-enoic acid
Property Insights of (E)-3-[5-fluoro-2-(trifluoromethyl)phenyl]prop-2-enoic acid
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-3-[5-fluoro-2-(trifluoromethyl)phenyl]prop-2-enoic acid. With a topological polar surface area (TPSA) of 37.3 Ų, (E)-3-[5-fluoro-2-(trifluoromethyl)phenyl]prop-2-enoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-3-[5-fluoro-2-(trifluoromethyl)phenyl]prop-2-enoic acid has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (E)-3-[5-fluoro-2-(trifluoromethyl)phenyl]prop-2-enoic acid?
The CAS number of (E)-3-[5-fluoro-2-(trifluoromethyl)phenyl]prop-2-enoic acid is 1184721-90-1.
What is the molecular formula of (E)-3-[5-fluoro-2-(trifluoromethyl)phenyl]prop-2-enoic acid?
The molecular formula of (E)-3-[5-fluoro-2-(trifluoromethyl)phenyl]prop-2-enoic acid is C10H6F4O2.
What is the molecular weight of (E)-3-[5-fluoro-2-(trifluoromethyl)phenyl]prop-2-enoic acid?
The molecular weight of (E)-3-[5-fluoro-2-(trifluoromethyl)phenyl]prop-2-enoic acid is 234.0304 g/mol.
Where can I buy (E)-3-[5-fluoro-2-(trifluoromethyl)phenyl]prop-2-enoic acid?
You can request a quote for (E)-3-[5-fluoro-2-(trifluoromethyl)phenyl]prop-2-enoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (E)-3-[5-fluoro-2-(trifluoromethyl)phenyl]prop-2-enoic acid?
Yes, CoreyChem provides custom synthesis services for (E)-3-[5-fluoro-2-(trifluoromethyl)phenyl]prop-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.