1,3-Dioxole, 2,2,4-trifluoro-5-(trifluoromethoxy)-
TL;DR: 1,3-Dioxole, 2,2,4-trifluoro-5-(trifluoromethoxy)- (CAS 161611-74-1) is a chemical compound with molecular formula C4F6O3 and molecular weight 209.97516 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,2,4-trifluoro-5-(trifluoromethoxy)-1,3-dioxole
Also Known As: 1,3-Dioxole, 2,2,4-trifluoro-5-(trifluoromethoxy)-, 2,2,4-trifluoro-5-(trifluoromethoxy)-1,3-dioxole, 2,2,4-trifluoro-5-trifluoromethoxy-1,3-dioxole, J1.929.337H, 2,2,4-trifluoro-5-(trifluoromethoxy)-2H-1,3-dioxole
Technical Specifications
| Molecular Formula | C4F6O3 |
| Molecular Weight | 209.97516 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 1 |
| Exact Mass | 209.97516 Da |
| Heavy Atoms | 13 |
| Complexity | 243.0 |
| SMILES | C1(=C(OC(O1)(F)F)F)OC(F)(F)F |
| InChIKey | JSGITCLSCUKHFW-UHFFFAOYSA-N |
Chemical Property Profile of 1,3-Dioxole, 2,2,4-trifluoro-5-(trifluoromethoxy)-
Property Insights of 1,3-Dioxole, 2,2,4-trifluoro-5-(trifluoromethoxy)-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dioxole, 2,2,4-trifluoro-5-(trifluoromethoxy)-. With a topological polar surface area (TPSA) of 27.7 Ų, 1,3-Dioxole, 2,2,4-trifluoro-5-(trifluoromethoxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dioxole, 2,2,4-trifluoro-5-(trifluoromethoxy)- has 0 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 1,3-Dioxole, 2,2,4-trifluoro-5-(trifluoromethoxy)-?
The CAS number of 1,3-Dioxole, 2,2,4-trifluoro-5-(trifluoromethoxy)- is 161611-74-1.
What is the molecular formula of 1,3-Dioxole, 2,2,4-trifluoro-5-(trifluoromethoxy)-?
The molecular formula of 1,3-Dioxole, 2,2,4-trifluoro-5-(trifluoromethoxy)- is C4F6O3.
What is the molecular weight of 1,3-Dioxole, 2,2,4-trifluoro-5-(trifluoromethoxy)-?
The molecular weight of 1,3-Dioxole, 2,2,4-trifluoro-5-(trifluoromethoxy)- is 209.97516 g/mol.
Where can I buy 1,3-Dioxole, 2,2,4-trifluoro-5-(trifluoromethoxy)-?
You can request a quote for 1,3-Dioxole, 2,2,4-trifluoro-5-(trifluoromethoxy)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,3-Dioxole, 2,2,4-trifluoro-5-(trifluoromethoxy)-?
Yes, CoreyChem provides custom synthesis services for 1,3-Dioxole, 2,2,4-trifluoro-5-(trifluoromethoxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.