2,3,5-Trifluorocinnamic acid
TL;DR: 2,3,5-Trifluorocinnamic acid (CAS 1384157-92-9) is a chemical compound with molecular formula C9H5F3O2 and molecular weight 202.02417 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-3-(2,3,5-trifluorophenyl)prop-2-enoic acid
Also Known As: 2,3,5-Trifluorocinnamic acid, 2,3,5-TrifluorocinnamicAcid, 235-Trifluorocinnamic acid, (2E)-3-(2,3,5-trifluorophenyl)prop-2-enoic acid, (E)-3-(2,3,5-trifluorophenyl)prop-2-enoic acid
Technical Specifications
| Molecular Formula | C9H5F3O2 |
| Molecular Weight | 202.02417 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 202.02417 Da |
| Heavy Atoms | 14 |
| Complexity | 242.0 |
| SMILES | C1=C(C=C(C(=C1/C=C/C(=O)O)F)F)F |
| InChIKey | FHDPERUKPYYNEO-OWOJBTEDSA-N |
Chemical Property Profile of 2,3,5-Trifluorocinnamic acid
Property Insights of 2,3,5-Trifluorocinnamic acid
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3,5-Trifluorocinnamic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 2,3,5-Trifluorocinnamic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,5-Trifluorocinnamic acid has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2,3,5-Trifluorocinnamic acid?
The CAS number of 2,3,5-Trifluorocinnamic acid is 1384157-92-9.
What is the molecular formula of 2,3,5-Trifluorocinnamic acid?
The molecular formula of 2,3,5-Trifluorocinnamic acid is C9H5F3O2.
What is the molecular weight of 2,3,5-Trifluorocinnamic acid?
The molecular weight of 2,3,5-Trifluorocinnamic acid is 202.02417 g/mol.
Where can I buy 2,3,5-Trifluorocinnamic acid?
You can request a quote for 2,3,5-Trifluorocinnamic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,3,5-Trifluorocinnamic acid?
Yes, CoreyChem provides custom synthesis services for 2,3,5-Trifluorocinnamic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.