Ethyl 2-(3-nitrophenoxy)acetate
TL;DR: Ethyl 2-(3-nitrophenoxy)acetate (CAS 5544-77-4) is a chemical compound with molecular formula C10H11NO5 and molecular weight 225.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(3-nitrophenoxy)acetate
Also Known As: ethyl 2-(3-nitrophenoxy)acetate, (3-NITROPHENOXY) ACETIC ACID ETHYL ESTER, ACETICACIDETHYLESTER, ethyl 3-nitrophenoxyacetate, Ethyl (3-nitrophenoxy)acetate
| Molecular Formula | C10H11NO5 |
|---|---|
| Molecular Weight | 225.06 g/mol |
| LogP | 1.5367 |
| Topological Polar Surface Area | 78.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 225.06372 |
| Heavy Atoms | 16 |
| Complexity | 390.55072 |
Chemical Identifiers
| CAS Number | 5544-77-4 |
|---|---|
| SMILES | CCOC(=O)COC1=CC=CC(=C1)[N+](=O)[O-] |
Product Overview
Ethyl 2-(3-nitrophenoxy)acetate (CAS 5544-77-4), with molecular formula C10H11NO5 and molecular weight 225.06 g/mol. IUPAC: ethyl 2-(3-nitrophenoxy)acetate.
Chemical Property Profile of Ethyl 2-(3-nitrophenoxy)acetate
Property Insights of Ethyl 2-(3-nitrophenoxy)acetate
The XLogP value of 1.5367 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-(3-nitrophenoxy)acetate. The TPSA of 78.67 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-(3-nitrophenoxy)acetate. Following Lipinski's Rule of Five, Ethyl 2-(3-nitrophenoxy)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 Ethyl 2-(3-nitrophenoxy)acetate?
The CAS number of Ethyl 2-(3-nitrophenoxy)acetate is 5544-77-4.
What is the molecular formula of Ethyl 2-(3-nitrophenoxy)acetate?
The molecular formula of Ethyl 2-(3-nitrophenoxy)acetate is C10H11NO5.
What is the molecular weight of Ethyl 2-(3-nitrophenoxy)acetate?
The molecular weight of Ethyl 2-(3-nitrophenoxy)acetate is 225.06 g/mol.
Where can I buy Ethyl 2-(3-nitrophenoxy)acetate?
You can request a quote for Ethyl 2-(3-nitrophenoxy)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-(3-nitrophenoxy)acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(3-nitrophenoxy)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.