Valeric acid, 3-hydroxy-5,5,5-trifluoro-4-(trifluoromethyl)-
TL;DR: Valeric acid, 3-hydroxy-5,5,5-trifluoro-4-(trifluoromethyl)- (CAS 63979-48-6) is a chemical compound with molecular formula C6H6F6O3 and molecular weight 240.02211 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5,5,5-trifluoro-3-hydroxy-4-(trifluoromethyl)pentanoic acid
Also Known As: PYRIDOXAL HYDROCHLORIDE, 3-Hydroxy-5,5,5-trifluoro-4-(trifluoromethyl)valeric acid, 5,5,5-trifluoro-3-hydroxy-4-(trifluoromethyl)pentanoic acid, Butyric acid, 4,4-bis(trifluoromethyl)-3-hydroxy-, Valeric acid, 3-hydroxy-5,5,5-trifluoro-4-(trifluoromethyl)-
Technical Specifications
| Molecular Formula | C6H6F6O3 |
| Molecular Weight | 240.02211 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 240.02211 Da |
| Heavy Atoms | 15 |
| Complexity | 218.0 |
| SMILES | C(C(C(C(F)(F)F)C(F)(F)F)O)C(=O)O |
| InChIKey | JQYOPIYXOULLDJ-UHFFFAOYSA-N |
Chemical Property Profile of Valeric acid, 3-hydroxy-5,5,5-trifluoro-4-(trifluoromethyl)-
Property Insights of Valeric acid, 3-hydroxy-5,5,5-trifluoro-4-(trifluoromethyl)-
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Valeric acid, 3-hydroxy-5,5,5-trifluoro-4-(trifluoromethyl)-. With a topological polar surface area (TPSA) of 57.5 Ų, Valeric acid, 3-hydroxy-5,5,5-trifluoro-4-(trifluoromethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Valeric acid, 3-hydroxy-5,5,5-trifluoro-4-(trifluoromethyl)- has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Valeric acid, 3-hydroxy-5,5,5-trifluoro-4-(trifluoromethyl)-?
The CAS number of Valeric acid, 3-hydroxy-5,5,5-trifluoro-4-(trifluoromethyl)- is 63979-48-6.
What is the molecular formula of Valeric acid, 3-hydroxy-5,5,5-trifluoro-4-(trifluoromethyl)-?
The molecular formula of Valeric acid, 3-hydroxy-5,5,5-trifluoro-4-(trifluoromethyl)- is C6H6F6O3.
What is the molecular weight of Valeric acid, 3-hydroxy-5,5,5-trifluoro-4-(trifluoromethyl)-?
The molecular weight of Valeric acid, 3-hydroxy-5,5,5-trifluoro-4-(trifluoromethyl)- is 240.02211 g/mol.
Where can I buy Valeric acid, 3-hydroxy-5,5,5-trifluoro-4-(trifluoromethyl)-?
You can request a quote for Valeric acid, 3-hydroxy-5,5,5-trifluoro-4-(trifluoromethyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Valeric acid, 3-hydroxy-5,5,5-trifluoro-4-(trifluoromethyl)-?
Yes, CoreyChem provides custom synthesis services for Valeric acid, 3-hydroxy-5,5,5-trifluoro-4-(trifluoromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.