4-(Trifluoromethyl)cyclohexanecarboxylic acid
TL;DR: 4-(Trifluoromethyl)cyclohexanecarboxylic acid (CAS 1202578-27-5) is a chemical compound with molecular formula C8H11F3O2 and molecular weight 196.07112 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(trifluoromethyl)cyclohexane-1-carboxylic acid
Also Known As: 4-(Trifluoromethyl)cyclohexanecarboxylic Acid, cis-4-(Trifluoromethyl)cyclohexanecarboxylic Acid, trans-4-(Trifluoromethyl)cyclohexanecarboxylic Acid, null, 4-(trifluoromethyl)cyclohexane-1-carboxylic Acid
Technical Specifications
| Molecular Formula | C8H11F3O2 |
| Molecular Weight | 196.07112 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 196.07112 Da |
| Heavy Atoms | 13 |
| Complexity | 192.0 |
| SMILES | C1CC(CCC1C(=O)O)C(F)(F)F |
| InChIKey | LMEAZIIFLVDISW-UHFFFAOYSA-N |
Chemical Property Profile of 4-(Trifluoromethyl)cyclohexanecarboxylic acid
Property Insights of 4-(Trifluoromethyl)cyclohexanecarboxylic acid
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Trifluoromethyl)cyclohexanecarboxylic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 4-(Trifluoromethyl)cyclohexanecarboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Trifluoromethyl)cyclohexanecarboxylic 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 4-(Trifluoromethyl)cyclohexanecarboxylic acid?
The CAS number of 4-(Trifluoromethyl)cyclohexanecarboxylic acid is 1202578-27-5.
What is the molecular formula of 4-(Trifluoromethyl)cyclohexanecarboxylic acid?
The molecular formula of 4-(Trifluoromethyl)cyclohexanecarboxylic acid is C8H11F3O2.
What is the molecular weight of 4-(Trifluoromethyl)cyclohexanecarboxylic acid?
The molecular weight of 4-(Trifluoromethyl)cyclohexanecarboxylic acid is 196.07112 g/mol.
Where can I buy 4-(Trifluoromethyl)cyclohexanecarboxylic acid?
You can request a quote for 4-(Trifluoromethyl)cyclohexanecarboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(Trifluoromethyl)cyclohexanecarboxylic acid?
Yes, CoreyChem provides custom synthesis services for 4-(Trifluoromethyl)cyclohexanecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.