4-Fluoro-4'-nitrochalcone
TL;DR: 4-Fluoro-4'-nitrochalcone (CAS 102692-39-7) is a chemical compound with molecular formula C15H10FNO3 and molecular weight 271.06448 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-3-(4-fluorophenyl)-1-(4-nitrophenyl)prop-2-en-1-one
Also Known As: 4-Fluoro-4'-nitrochalcone, 4-fluoro-4'-nitro-trans-chalcone, (E)-3-(4-fluorophenyl)-1-(4-nitrophenyl)prop-2-en-1-one, (2E)-3-(4-fluorophenyl)-1-(4-nitrophenyl)prop-2-en-1-one, 3-(4-fluorophenyl)-1-(4-nitrophenyl)prop-2-en-1-one
Technical Specifications
| Molecular Formula | C15H10FNO3 |
| Molecular Weight | 271.06448 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 62.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 271.06448 Da |
| Heavy Atoms | 20 |
| Complexity | 375.0 |
| SMILES | C1=CC(=CC=C1/C=C/C(=O)C2=CC=C(C=C2)[N+](=O)[O-])F |
| InChIKey | YMQIOFDMELMTTG-XCVCLJGOSA-N |
Chemical Property Profile of 4-Fluoro-4'-nitrochalcone
Property Insights of 4-Fluoro-4'-nitrochalcone
The XLogP value of 3.0 indicates that 4-Fluoro-4'-nitrochalcone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Fluoro-4'-nitrochalcone. Following Lipinski's Rule of Five, 4-Fluoro-4'-nitrochalcone 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 4-Fluoro-4'-nitrochalcone?
The CAS number of 4-Fluoro-4'-nitrochalcone is 102692-39-7.
What is the molecular formula of 4-Fluoro-4'-nitrochalcone?
The molecular formula of 4-Fluoro-4'-nitrochalcone is C15H10FNO3.
What is the molecular weight of 4-Fluoro-4'-nitrochalcone?
The molecular weight of 4-Fluoro-4'-nitrochalcone is 271.06448 g/mol.
Where can I buy 4-Fluoro-4'-nitrochalcone?
You can request a quote for 4-Fluoro-4'-nitrochalcone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Fluoro-4'-nitrochalcone?
Yes, CoreyChem provides custom synthesis services for 4-Fluoro-4'-nitrochalcone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.