Ethyl 2-[2-(acetylamino)-4-nitrophenoxy]propanoate
TL;DR: Ethyl 2-[2-(acetylamino)-4-nitrophenoxy]propanoate (CAS 893780-18-2) is a chemical compound with molecular formula C13H16N2O6 and molecular weight 296.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(2-acetamido-4-nitrophenoxy)propanoate
Also Known As: ethyl 2-[2-(acetylamino)-4-nitrophenoxy]propanoate, ethyl 2-(2-acetamido-4-nitrophenoxy)propanoate, ethyl2-(2-acetamido-4-nitrophenoxy)propanoate, ethyl 2-(2-acetamido-4-nitro-phenoxy)propanoate, Ethyl 2-2-(acetylamino)-4-nitrophenoxypropanoate
| Molecular Formula | C13H16N2O6 |
|---|---|
| Molecular Weight | 296.10 g/mol |
| LogP | 1.8836 |
| Topological Polar Surface Area | 107.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 296.10083 |
| Heavy Atoms | 21 |
| Complexity | 557.5925 |
Chemical Identifiers
| CAS Number | 893780-18-2 |
|---|---|
| SMILES | CCOC(=O)C(C)OC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C |
Product Overview
Ethyl 2-[2-(acetylamino)-4-nitrophenoxy]propanoate (CAS 893780-18-2), with molecular formula C13H16N2O6 and molecular weight 296.10 g/mol. IUPAC: ethyl 2-(2-acetamido-4-nitrophenoxy)propanoate.
Chemical Property Profile of Ethyl 2-[2-(acetylamino)-4-nitrophenoxy]propanoate
Property Insights of Ethyl 2-[2-(acetylamino)-4-nitrophenoxy]propanoate
The XLogP value of 1.8836 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-[2-(acetylamino)-4-nitrophenoxy]propanoate. The TPSA of 107.77 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-[2-(acetylamino)-4-nitrophenoxy]propanoate. Following Lipinski's Rule of Five, Ethyl 2-[2-(acetylamino)-4-nitrophenoxy]propanoate has 1 hydrogen bond donor(s) and 6 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 Ethyl 2-[2-(acetylamino)-4-nitrophenoxy]propanoate?
The CAS number of Ethyl 2-[2-(acetylamino)-4-nitrophenoxy]propanoate is 893780-18-2.
What is the molecular formula of Ethyl 2-[2-(acetylamino)-4-nitrophenoxy]propanoate?
The molecular formula of Ethyl 2-[2-(acetylamino)-4-nitrophenoxy]propanoate is C13H16N2O6.
What is the molecular weight of Ethyl 2-[2-(acetylamino)-4-nitrophenoxy]propanoate?
The molecular weight of Ethyl 2-[2-(acetylamino)-4-nitrophenoxy]propanoate is 296.10 g/mol.
Where can I buy Ethyl 2-[2-(acetylamino)-4-nitrophenoxy]propanoate?
You can request a quote for Ethyl 2-[2-(acetylamino)-4-nitrophenoxy]propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-[2-(acetylamino)-4-nitrophenoxy]propanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-[2-(acetylamino)-4-nitrophenoxy]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.