2,5-Bis(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)cyclopentan-1-one
TL;DR: 2,5-Bis(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)cyclopentan-1-one (CAS 102029-88-9) is a chemical compound with molecular formula C11H8F12O3 and molecular weight 416.02817 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,5-bis(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)cyclopentan-1-one
Also Known As: NCI60_022081, 2,5-Bis(2,2,2-trifluoro-1-hydroxy-1-(trifluoromethyl)ethyl)cyclopentanone, 2,5-bis(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)cyclopentan-1-one, 2,5-Bis(1,1,1,3,3,3-hexafluoro-2-hydroxy-2-propyl)cyclopentanone, Cyclopentanone, 2,5-bis(1,1,1,3,3,3-hexafluoro-2-hydroxy-2-propyl)-
Technical Specifications
| Molecular Formula | C11H8F12O3 |
| Molecular Weight | 416.02817 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 2 |
| Exact Mass | 416.02817 Da |
| Heavy Atoms | 26 |
| Complexity | 479.0 |
| SMILES | C1CC(C(=O)C1C(C(F)(F)F)(C(F)(F)F)O)C(C(F)(F)F)(C(F)(F)F)O |
| InChIKey | NVMISAZNGOTJHN-UHFFFAOYSA-N |
Chemical Property Profile of 2,5-Bis(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)cyclopentan-1-one
Property Insights of 2,5-Bis(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)cyclopentan-1-one
The XLogP value of 3.9 indicates that 2,5-Bis(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)cyclopentan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.5 Ų, 2,5-Bis(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)cyclopentan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Bis(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)cyclopentan-1-one has 2 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 2,5-Bis(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)cyclopentan-1-one?
The CAS number of 2,5-Bis(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)cyclopentan-1-one is 102029-88-9.
What is the molecular formula of 2,5-Bis(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)cyclopentan-1-one?
The molecular formula of 2,5-Bis(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)cyclopentan-1-one is C11H8F12O3.
What is the molecular weight of 2,5-Bis(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)cyclopentan-1-one?
The molecular weight of 2,5-Bis(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)cyclopentan-1-one is 416.02817 g/mol.
Where can I buy 2,5-Bis(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)cyclopentan-1-one?
You can request a quote for 2,5-Bis(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)cyclopentan-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,5-Bis(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)cyclopentan-1-one?
Yes, CoreyChem provides custom synthesis services for 2,5-Bis(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)cyclopentan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.