2-(4-Fluorophenyl)-1-(2,3,4-trihydroxyphenyl)ethan-1-one
TL;DR: 2-(4-Fluorophenyl)-1-(2,3,4-trihydroxyphenyl)ethan-1-one (CAS 116719-24-5) is a chemical compound with molecular formula C14H11FO4 and molecular weight 262.06415 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-fluorophenyl)-1-(2,3,4-trihydroxyphenyl)ethanone
Also Known As: BAS 00634309, 2-(4-fluorophenyl)-1-(2,3,4-trihydroxyphenyl)ethan-1-one, 2-(4-fluorophenyl)-1-(2,3,4-trihydroxyphenyl)ethanone, 2-(4-Fluoro-phenyl)-1-(2,3,4-trihydroxy-phenyl)-ethanone
Technical Specifications
| Molecular Formula | C14H11FO4 |
| Molecular Weight | 262.06415 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 77.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 262.06415 Da |
| Heavy Atoms | 19 |
| Complexity | 315.0 |
| SMILES | C1=CC(=CC=C1CC(=O)C2=C(C(=C(C=C2)O)O)O)F |
| InChIKey | AJUOCCICGXUFGN-UHFFFAOYSA-N |
Chemical Property Profile of 2-(4-Fluorophenyl)-1-(2,3,4-trihydroxyphenyl)ethan-1-one
Property Insights of 2-(4-Fluorophenyl)-1-(2,3,4-trihydroxyphenyl)ethan-1-one
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Fluorophenyl)-1-(2,3,4-trihydroxyphenyl)ethan-1-one. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Fluorophenyl)-1-(2,3,4-trihydroxyphenyl)ethan-1-one. Following Lipinski's Rule of Five, 2-(4-Fluorophenyl)-1-(2,3,4-trihydroxyphenyl)ethan-1-one has 3 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 2-(4-Fluorophenyl)-1-(2,3,4-trihydroxyphenyl)ethan-1-one?
The CAS number of 2-(4-Fluorophenyl)-1-(2,3,4-trihydroxyphenyl)ethan-1-one is 116719-24-5.
What is the molecular formula of 2-(4-Fluorophenyl)-1-(2,3,4-trihydroxyphenyl)ethan-1-one?
The molecular formula of 2-(4-Fluorophenyl)-1-(2,3,4-trihydroxyphenyl)ethan-1-one is C14H11FO4.
What is the molecular weight of 2-(4-Fluorophenyl)-1-(2,3,4-trihydroxyphenyl)ethan-1-one?
The molecular weight of 2-(4-Fluorophenyl)-1-(2,3,4-trihydroxyphenyl)ethan-1-one is 262.06415 g/mol.
Where can I buy 2-(4-Fluorophenyl)-1-(2,3,4-trihydroxyphenyl)ethan-1-one?
You can request a quote for 2-(4-Fluorophenyl)-1-(2,3,4-trihydroxyphenyl)ethan-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(4-Fluorophenyl)-1-(2,3,4-trihydroxyphenyl)ethan-1-one?
Yes, CoreyChem provides custom synthesis services for 2-(4-Fluorophenyl)-1-(2,3,4-trihydroxyphenyl)ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.