![[1-(4-Nitrophenyl)-2-oxo-2-phenylethyl] acetate structure](/static/products/119/119123-51-2.png)
[1-(4-Nitrophenyl)-2-oxo-2-phenylethyl] acetate
TL;DR: [1-(4-Nitrophenyl)-2-oxo-2-phenylethyl] acetate (CAS 119123-51-2) is a chemical compound with molecular formula C16H13NO5 and molecular weight 299.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(4-nitrophenyl)-2-oxo-2-phenylethyl] acetate
Also Known As: [1-(4-nitrophenyl)-2-oxo-2-phenylethyl] acetate|Ethanone, 2-(acetyloxy)-2-(4-nitrophenyl)-1-phenyl- (en)
| Molecular Formula | C16H13NO5 |
|---|---|
| Molecular Weight | 299.08 g/mol |
| LogP | 3.0819 |
| Topological Polar Surface Area | 86.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 299.07938 |
| Heavy Atoms | 22 |
| Complexity | 694.2359 |
Chemical Identifiers
| CAS Number | 119123-51-2 |
|---|---|
| SMILES | CC(=O)OC(C1=CC=C(C=C1)[N+](=O)[O-])C(=O)C2=CC=CC=C2 |
Product Overview
[1-(4-Nitrophenyl)-2-oxo-2-phenylethyl] acetate (CAS 119123-51-2), with molecular formula C16H13NO5 and molecular weight 299.08 g/mol. IUPAC: [1-(4-nitrophenyl)-2-oxo-2-phenylethyl] acetate.
Chemical Property Profile of [1-(4-Nitrophenyl)-2-oxo-2-phenylethyl] acetate
Property Insights of [1-(4-Nitrophenyl)-2-oxo-2-phenylethyl] acetate
The XLogP value of 3.0819 indicates that [1-(4-Nitrophenyl)-2-oxo-2-phenylethyl] acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.51 Ų falls within the moderate polarity range, balancing permeability and solubility for [1-(4-Nitrophenyl)-2-oxo-2-phenylethyl] acetate. Following Lipinski's Rule of Five, [1-(4-Nitrophenyl)-2-oxo-2-phenylethyl] acetate has 0 hydrogen bond donor(s) and 5 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-Nitrophenyl)-2-oxo-2-phenylethyl] acetate?
The CAS number of [1-(4-Nitrophenyl)-2-oxo-2-phenylethyl] acetate is 119123-51-2.
What is the molecular formula of [1-(4-Nitrophenyl)-2-oxo-2-phenylethyl] acetate?
The molecular formula of [1-(4-Nitrophenyl)-2-oxo-2-phenylethyl] acetate is C16H13NO5.
What is the molecular weight of [1-(4-Nitrophenyl)-2-oxo-2-phenylethyl] acetate?
The molecular weight of [1-(4-Nitrophenyl)-2-oxo-2-phenylethyl] acetate is 299.08 g/mol.
Where can I buy [1-(4-Nitrophenyl)-2-oxo-2-phenylethyl] acetate?
You can request a quote for [1-(4-Nitrophenyl)-2-oxo-2-phenylethyl] acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1-(4-Nitrophenyl)-2-oxo-2-phenylethyl] acetate?
Yes, KEHONG BIO provides custom synthesis services for [1-(4-Nitrophenyl)-2-oxo-2-phenylethyl] acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.