![1-[4-(4-Nitrophenoxy)phenyl]ethanone structure](/static/products/5228/5228-16-0.webp)
1-[4-(4-Nitrophenoxy)phenyl]ethanone
TL;DR: 1-[4-(4-Nitrophenoxy)phenyl]ethanone (CAS 5228-16-0) is a chemical compound with molecular formula C14H11NO4 and molecular weight 257.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(4-nitrophenoxy)phenyl]ethanone
Also Known As: 1-[4-(4-nitrophenoxy)phenyl]ethanone, 4-ACETYL-4'-NITRODIPHENYL ETHER, 1-(4-(4-NITROPHENOXY)PHENYL)ETHANONE, 4-Acetyl-4-nitrodiphenyl ether, Maybridge1_003157
| Molecular Formula | C14H11NO4 |
|---|---|
| Molecular Weight | 257.07 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 72.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 257.06882 |
| Heavy Atoms | 19 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 5228-16-0 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)OC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | IRWXEFXORSDYQA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-[4-(4-Nitrophenoxy)phenyl]ethanone (CAS 5228-16-0), with molecular formula C14H11NO4 and molecular weight 257.07 g/mol. IUPAC: 1-[4-(4-nitrophenoxy)phenyl]ethanone.
Chemical Property Profile of 1-[4-(4-Nitrophenoxy)phenyl]ethanone
Property Insights of 1-[4-(4-Nitrophenoxy)phenyl]ethanone
The XLogP value of 3.1 indicates that 1-[4-(4-Nitrophenoxy)phenyl]ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[4-(4-Nitrophenoxy)phenyl]ethanone. Following Lipinski's Rule of Five, 1-[4-(4-Nitrophenoxy)phenyl]ethanone 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 1-[4-(4-Nitrophenoxy)phenyl]ethanone?
The CAS number of 1-[4-(4-Nitrophenoxy)phenyl]ethanone is 5228-16-0.
What is the molecular formula of 1-[4-(4-Nitrophenoxy)phenyl]ethanone?
The molecular formula of 1-[4-(4-Nitrophenoxy)phenyl]ethanone is C14H11NO4.
What is the molecular weight of 1-[4-(4-Nitrophenoxy)phenyl]ethanone?
The molecular weight of 1-[4-(4-Nitrophenoxy)phenyl]ethanone is 257.07 g/mol.
Where can I buy 1-[4-(4-Nitrophenoxy)phenyl]ethanone?
You can request a quote for 1-[4-(4-Nitrophenoxy)phenyl]ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[4-(4-Nitrophenoxy)phenyl]ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-(4-Nitrophenoxy)phenyl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.