3-(2-Fluorophenyl)-1-(4-nitrophenyl)prop-2-en-1-one
TL;DR: 3-(2-Fluorophenyl)-1-(4-nitrophenyl)prop-2-en-1-one (CAS 2805-52-9) is a chemical compound with molecular formula C15H10FNO3 and molecular weight 271.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-fluorophenyl)-1-(4-nitrophenyl)prop-2-en-1-one
Also Known As: NCI60_006490, 3-(2-fluorophenyl)-1-(4-nitrophenyl)prop-2-en-1-one, (2E)-3-(2-Fluorophenyl)-1-(4-nitrophenyl)prop-2-en-1-one, (E)-3-(2-fluorophenyl)-1-(4-nitrophenyl)prop-2-en-1-one
| Molecular Formula | C15H10FNO3 |
|---|---|
| Molecular Weight | 271.06 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 62.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 271.06448 |
| Heavy Atoms | 20 |
| Complexity | 383.0 |
Chemical Identifiers
| CAS Number | 2805-52-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C=CC(=O)C2=CC=C(C=C2)[N+](=O)[O-])F |
| InChIKey | WYZNBSVYZOTWGY-UHFFFAOYSA-N |
Product Overview
3-(2-Fluorophenyl)-1-(4-nitrophenyl)prop-2-en-1-one (CAS 2805-52-9), with molecular formula C15H10FNO3 and molecular weight 271.06 g/mol. IUPAC: 3-(2-fluorophenyl)-1-(4-nitrophenyl)prop-2-en-1-one.
Chemical Property Profile of 3-(2-Fluorophenyl)-1-(4-nitrophenyl)prop-2-en-1-one
Property Insights of 3-(2-Fluorophenyl)-1-(4-nitrophenyl)prop-2-en-1-one
The XLogP value of 3.6 indicates that 3-(2-Fluorophenyl)-1-(4-nitrophenyl)prop-2-en-1-one 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 3-(2-Fluorophenyl)-1-(4-nitrophenyl)prop-2-en-1-one. Following Lipinski's Rule of Five, 3-(2-Fluorophenyl)-1-(4-nitrophenyl)prop-2-en-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
Frequently Asked Questions
What is the CAS number of 3-(2-Fluorophenyl)-1-(4-nitrophenyl)prop-2-en-1-one?
The CAS number of 3-(2-Fluorophenyl)-1-(4-nitrophenyl)prop-2-en-1-one is 2805-52-9.
What is the molecular formula of 3-(2-Fluorophenyl)-1-(4-nitrophenyl)prop-2-en-1-one?
The molecular formula of 3-(2-Fluorophenyl)-1-(4-nitrophenyl)prop-2-en-1-one is C15H10FNO3.
What is the molecular weight of 3-(2-Fluorophenyl)-1-(4-nitrophenyl)prop-2-en-1-one?
The molecular weight of 3-(2-Fluorophenyl)-1-(4-nitrophenyl)prop-2-en-1-one is 271.06 g/mol.
Where can I buy 3-(2-Fluorophenyl)-1-(4-nitrophenyl)prop-2-en-1-one?
You can request a quote for 3-(2-Fluorophenyl)-1-(4-nitrophenyl)prop-2-en-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Fluorophenyl)-1-(4-nitrophenyl)prop-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Fluorophenyl)-1-(4-nitrophenyl)prop-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.