7,7,7-Trifluoro-6-hydroxy-2-methyl-6-phenyl-2-hepten-4-one
TL;DR: 7,7,7-Trifluoro-6-hydroxy-2-methyl-6-phenyl-2-hepten-4-one (CAS 126631-18-3) is a chemical compound with molecular formula C14H15F3O2 and molecular weight 272.10242 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7,7,7-trifluoro-6-hydroxy-2-methyl-6-phenylhept-2-en-4-one
Also Known As: 7,7,7-trifluoro-6-hydroxy-2-methyl-6-phenyl-2-hepten-4-one, BIM-0048022.P001, 7,7,7-trifluoro-6-hydroxy-2-methyl-6-phenylhept-2-en-4-one, AF-407/36112015
Technical Specifications
| Molecular Formula | C14H15F3O2 |
| Molecular Weight | 272.10242 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 272.10242 Da |
| Heavy Atoms | 19 |
| Complexity | 350.0 |
| SMILES | CC(=CC(=O)CC(C1=CC=CC=C1)(C(F)(F)F)O)C |
| InChIKey | BOMIGRXHKGXZQY-UHFFFAOYSA-N |
Chemical Property Profile of 7,7,7-Trifluoro-6-hydroxy-2-methyl-6-phenyl-2-hepten-4-one
Property Insights of 7,7,7-Trifluoro-6-hydroxy-2-methyl-6-phenyl-2-hepten-4-one
The XLogP value of 3.1 indicates that 7,7,7-Trifluoro-6-hydroxy-2-methyl-6-phenyl-2-hepten-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 7,7,7-Trifluoro-6-hydroxy-2-methyl-6-phenyl-2-hepten-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7,7,7-Trifluoro-6-hydroxy-2-methyl-6-phenyl-2-hepten-4-one has 1 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 7,7,7-Trifluoro-6-hydroxy-2-methyl-6-phenyl-2-hepten-4-one?
The CAS number of 7,7,7-Trifluoro-6-hydroxy-2-methyl-6-phenyl-2-hepten-4-one is 126631-18-3.
What is the molecular formula of 7,7,7-Trifluoro-6-hydroxy-2-methyl-6-phenyl-2-hepten-4-one?
The molecular formula of 7,7,7-Trifluoro-6-hydroxy-2-methyl-6-phenyl-2-hepten-4-one is C14H15F3O2.
What is the molecular weight of 7,7,7-Trifluoro-6-hydroxy-2-methyl-6-phenyl-2-hepten-4-one?
The molecular weight of 7,7,7-Trifluoro-6-hydroxy-2-methyl-6-phenyl-2-hepten-4-one is 272.10242 g/mol.
Where can I buy 7,7,7-Trifluoro-6-hydroxy-2-methyl-6-phenyl-2-hepten-4-one?
You can request a quote for 7,7,7-Trifluoro-6-hydroxy-2-methyl-6-phenyl-2-hepten-4-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 7,7,7-Trifluoro-6-hydroxy-2-methyl-6-phenyl-2-hepten-4-one?
Yes, CoreyChem provides custom synthesis services for 7,7,7-Trifluoro-6-hydroxy-2-methyl-6-phenyl-2-hepten-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.