3-(4-(Trifluoromethyl)phenyl)propionic Acid
TL;DR: 3-(4-(Trifluoromethyl)phenyl)propionic Acid (CAS 1093878-42-2) is a chemical compound with molecular formula C10H9F3O2 and molecular weight 218.05547 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[4-(trifluoromethyl)phenyl]propanoic acid
Also Known As: 4-(Trifluoromethyl)hydrocinnamic acid, 3-[4-(trifluoromethyl)phenyl]propanoic Acid, 3-[4-(Trifluoromethyl)phenyl]propionic acid, 3-(4-(trifluoromethyl)phenyl)propanoic acid, Cinacalcet Impurity 34
Technical Specifications
| Molecular Formula | C10H9F3O2 |
| Molecular Weight | 218.05547 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 218.05547 Da |
| Heavy Atoms | 15 |
| Complexity | 217.0 |
| SMILES | C1=CC(=CC=C1CCC(=O)O)C(F)(F)F |
| InChIKey | OEIUMLSCWINLBB-UHFFFAOYSA-N |
Chemical Property Profile of 3-(4-(Trifluoromethyl)phenyl)propionic Acid
Property Insights of 3-(4-(Trifluoromethyl)phenyl)propionic Acid
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-(Trifluoromethyl)phenyl)propionic Acid. With a topological polar surface area (TPSA) of 37.3 Ų, 3-(4-(Trifluoromethyl)phenyl)propionic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-(Trifluoromethyl)phenyl)propionic 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 3-(4-(Trifluoromethyl)phenyl)propionic Acid?
The CAS number of 3-(4-(Trifluoromethyl)phenyl)propionic Acid is 1093878-42-2.
What is the molecular formula of 3-(4-(Trifluoromethyl)phenyl)propionic Acid?
The molecular formula of 3-(4-(Trifluoromethyl)phenyl)propionic Acid is C10H9F3O2.
What is the molecular weight of 3-(4-(Trifluoromethyl)phenyl)propionic Acid?
The molecular weight of 3-(4-(Trifluoromethyl)phenyl)propionic Acid is 218.05547 g/mol.
Where can I buy 3-(4-(Trifluoromethyl)phenyl)propionic Acid?
You can request a quote for 3-(4-(Trifluoromethyl)phenyl)propionic Acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(4-(Trifluoromethyl)phenyl)propionic Acid?
Yes, CoreyChem provides custom synthesis services for 3-(4-(Trifluoromethyl)phenyl)propionic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.