1,1,1,5,5,5-Hexafluoro-4-methyl-3-penten-2-one
TL;DR: 1,1,1,5,5,5-Hexafluoro-4-methyl-3-penten-2-one (CAS 372-25-8) is a chemical compound with molecular formula C6H4F6O and molecular weight 206.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,1,5,5,5-hexafluoro-4-methylpent-3-en-2-one
Also Known As: Hexafluoromesityl oxide, 3-Penten-2-one, 1,1,1,5,5,5-hexafluoro-4-methyl-, 1,1,1,5,5,5-Hexafluoro-4-methylpent-3-en-2-one, 1,1,1,5,5,5-Hexafluoro-4-methyl-3-penten-2-one, (E)-1,1,1,5,5,5-hexafluoro-4-methylpent-3-en-2-one
| Molecular Formula | C6H4F6O |
|---|---|
| Molecular Weight | 206.02 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 206.01663 |
| Heavy Atoms | 13 |
| Complexity | 232.0 |
Chemical Identifiers
| CAS Number | 372-25-8 |
|---|---|
| SMILES | CC(=CC(=O)C(F)(F)F)C(F)(F)F |
| InChIKey | WRMWSVCCMDLQCJ-UHFFFAOYSA-N |
Product Overview
1,1,1,5,5,5-Hexafluoro-4-methyl-3-penten-2-one (CAS 372-25-8), with molecular formula C6H4F6O and molecular weight 206.02 g/mol. IUPAC: 1,1,1,5,5,5-hexafluoro-4-methylpent-3-en-2-one.
Chemical Property Profile of 1,1,1,5,5,5-Hexafluoro-4-methyl-3-penten-2-one
Property Insights of 1,1,1,5,5,5-Hexafluoro-4-methyl-3-penten-2-one
The XLogP value of 3.0 indicates that 1,1,1,5,5,5-Hexafluoro-4-methyl-3-penten-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 1,1,1,5,5,5-Hexafluoro-4-methyl-3-penten-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1,1,5,5,5-Hexafluoro-4-methyl-3-penten-2-one has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,1,1,5,5,5-Hexafluoro-4-methyl-3-penten-2-one?
The CAS number of 1,1,1,5,5,5-Hexafluoro-4-methyl-3-penten-2-one is 372-25-8.
What is the molecular formula of 1,1,1,5,5,5-Hexafluoro-4-methyl-3-penten-2-one?
The molecular formula of 1,1,1,5,5,5-Hexafluoro-4-methyl-3-penten-2-one is C6H4F6O.
What is the molecular weight of 1,1,1,5,5,5-Hexafluoro-4-methyl-3-penten-2-one?
The molecular weight of 1,1,1,5,5,5-Hexafluoro-4-methyl-3-penten-2-one is 206.02 g/mol.
Where can I buy 1,1,1,5,5,5-Hexafluoro-4-methyl-3-penten-2-one?
You can request a quote for 1,1,1,5,5,5-Hexafluoro-4-methyl-3-penten-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1,1,5,5,5-Hexafluoro-4-methyl-3-penten-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1,1,1,5,5,5-Hexafluoro-4-methyl-3-penten-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.