2-(4-Trifluoromethylbenzylidene)indan-1-one
TL;DR: 2-(4-Trifluoromethylbenzylidene)indan-1-one (CAS 150542-57-7) is a chemical compound with molecular formula C17H11F3O and molecular weight 288.0762 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2E)-2-[[4-(trifluoromethyl)phenyl]methylidene]-3H-inden-1-one
Also Known As: 2-(4-Trifluoromethylbenzylidene)indan-1-one, AB00765272-01, (2E)-2-[[4-(trifluoromethyl)phenyl]methylidene]-3H-inden-1-one, 2-[1-(4-Trifluoromethyl-phenyl)-meth-(E)-ylidene]-indan-1-one, (2E)-2,3-Dihydro-2-[[4-(trifluoromethyl)phenyl]methylene]-1H-inden-1-one
Technical Specifications
| Molecular Formula | C17H11F3O |
| Molecular Weight | 288.0762 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 288.0762 Da |
| Heavy Atoms | 21 |
| Complexity | 430.0 |
| SMILES | C\1C2=CC=CC=C2C(=O)/C1=C/C3=CC=C(C=C3)C(F)(F)F |
| InChIKey | PMOOCLYARYYYQU-UKTHLTGXSA-N |
Chemical Property Profile of 2-(4-Trifluoromethylbenzylidene)indan-1-one
Property Insights of 2-(4-Trifluoromethylbenzylidene)indan-1-one
The XLogP value of 4.7 indicates that 2-(4-Trifluoromethylbenzylidene)indan-1-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, 2-(4-Trifluoromethylbenzylidene)indan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Trifluoromethylbenzylidene)indan-1-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(4-Trifluoromethylbenzylidene)indan-1-one?
The CAS number of 2-(4-Trifluoromethylbenzylidene)indan-1-one is 150542-57-7.
What is the molecular formula of 2-(4-Trifluoromethylbenzylidene)indan-1-one?
The molecular formula of 2-(4-Trifluoromethylbenzylidene)indan-1-one is C17H11F3O.
What is the molecular weight of 2-(4-Trifluoromethylbenzylidene)indan-1-one?
The molecular weight of 2-(4-Trifluoromethylbenzylidene)indan-1-one is 288.0762 g/mol.
Where can I buy 2-(4-Trifluoromethylbenzylidene)indan-1-one?
You can request a quote for 2-(4-Trifluoromethylbenzylidene)indan-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(4-Trifluoromethylbenzylidene)indan-1-one?
Yes, CoreyChem provides custom synthesis services for 2-(4-Trifluoromethylbenzylidene)indan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.