Ethyl 2-(3-nitropyridin-2-yl)oxyacetate
TL;DR: Ethyl 2-(3-nitropyridin-2-yl)oxyacetate (CAS 136718-78-0) is a chemical compound with molecular formula C9H10N2O5 and molecular weight 226.05898 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-[(3-nitro-2-pyridinyl)oxy]acetate
Also Known As: Ethyl 2-(3-nitropyridin-2-yl)oxyacetate, Ethyl 2-((3-nitropyridin-2-yl)oxy)acetate, ETHYL 2-[(3-NITROPYRIDIN-2-YL)OXY]ACETATE, Ethyl [(3-nitropyridin-2-yl)oxy]acetate, ethyl 2-(3-nitro-2-pyridyloxy)acetate
Technical Specifications
| Molecular Formula | C9H10N2O5 |
| Molecular Weight | 226.05898 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 94.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 226.05898 Da |
| Heavy Atoms | 16 |
| Complexity | 253.0 |
| SMILES | CCOC(=O)COC1=C(C=CC=N1)[N+](=O)[O-] |
| InChIKey | XYNYNOQAHFLDQV-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 2-(3-nitropyridin-2-yl)oxyacetate
Property Insights of Ethyl 2-(3-nitropyridin-2-yl)oxyacetate
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-(3-nitropyridin-2-yl)oxyacetate. The TPSA of 94.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-(3-nitropyridin-2-yl)oxyacetate. Following Lipinski's Rule of Five, Ethyl 2-(3-nitropyridin-2-yl)oxyacetate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ethyl 2-(3-nitropyridin-2-yl)oxyacetate?
The CAS number of Ethyl 2-(3-nitropyridin-2-yl)oxyacetate is 136718-78-0.
What is the molecular formula of Ethyl 2-(3-nitropyridin-2-yl)oxyacetate?
The molecular formula of Ethyl 2-(3-nitropyridin-2-yl)oxyacetate is C9H10N2O5.
What is the molecular weight of Ethyl 2-(3-nitropyridin-2-yl)oxyacetate?
The molecular weight of Ethyl 2-(3-nitropyridin-2-yl)oxyacetate is 226.05898 g/mol.
Where can I buy Ethyl 2-(3-nitropyridin-2-yl)oxyacetate?
You can request a quote for Ethyl 2-(3-nitropyridin-2-yl)oxyacetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 2-(3-nitropyridin-2-yl)oxyacetate?
Yes, CoreyChem provides custom synthesis services for Ethyl 2-(3-nitropyridin-2-yl)oxyacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.