5,5-Dimethyl-3-(trifluoromethyl)oxolan-2-one
TL;DR: 5,5-Dimethyl-3-(trifluoromethyl)oxolan-2-one (CAS 164929-15-1) is a chemical compound with molecular formula C7H9F3O2 and molecular weight 182.05547 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5,5-dimethyl-3-(trifluoromethyl)oxolan-2-one
Also Known As: 5,5-dimethyl-3-(trifluoromethyl)oxolan-2-one, 5,5-Dimethyl-3-(trifluoromethyl)dihydrofuran-2(3H)-one, gamma-Methyl-alpha-(trifluoromethyl)-gamma-valerolactone, A-Methyl-, A-(trifluoromethyl)-
Technical Specifications
| Molecular Formula | C7H9F3O2 |
| Molecular Weight | 182.05547 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 182.05547 Da |
| Heavy Atoms | 12 |
| Complexity | 207.0 |
| SMILES | CC1(CC(C(=O)O1)C(F)(F)F)C |
| InChIKey | NSQKIHBAKTVICL-UHFFFAOYSA-N |
Chemical Property Profile of 5,5-Dimethyl-3-(trifluoromethyl)oxolan-2-one
Property Insights of 5,5-Dimethyl-3-(trifluoromethyl)oxolan-2-one
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,5-Dimethyl-3-(trifluoromethyl)oxolan-2-one. With a topological polar surface area (TPSA) of 26.3 Ų, 5,5-Dimethyl-3-(trifluoromethyl)oxolan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,5-Dimethyl-3-(trifluoromethyl)oxolan-2-one has 0 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 5,5-Dimethyl-3-(trifluoromethyl)oxolan-2-one?
The CAS number of 5,5-Dimethyl-3-(trifluoromethyl)oxolan-2-one is 164929-15-1.
What is the molecular formula of 5,5-Dimethyl-3-(trifluoromethyl)oxolan-2-one?
The molecular formula of 5,5-Dimethyl-3-(trifluoromethyl)oxolan-2-one is C7H9F3O2.
What is the molecular weight of 5,5-Dimethyl-3-(trifluoromethyl)oxolan-2-one?
The molecular weight of 5,5-Dimethyl-3-(trifluoromethyl)oxolan-2-one is 182.05547 g/mol.
Where can I buy 5,5-Dimethyl-3-(trifluoromethyl)oxolan-2-one?
You can request a quote for 5,5-Dimethyl-3-(trifluoromethyl)oxolan-2-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5,5-Dimethyl-3-(trifluoromethyl)oxolan-2-one?
Yes, CoreyChem provides custom synthesis services for 5,5-Dimethyl-3-(trifluoromethyl)oxolan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.