![Ethyl 2-ethyl-3-[(2-nitrobenzoyl)hydrazono]butanoate structure](/static/products/314/314764-91-5.png)
Ethyl 2-ethyl-3-[(2-nitrobenzoyl)hydrazono]butanoate
TL;DR: Ethyl 2-ethyl-3-[(2-nitrobenzoyl)hydrazono]butanoate (CAS 314764-91-5) is a chemical compound with molecular formula C15H19N3O5 and molecular weight 321.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (3E)-2-ethyl-3-[(2-nitrobenzoyl)hydrazinylidene]butanoate
Also Known As: ethyl 2-ethyl-3-[(2-nitrobenzoyl)hydrazono]butanoate, ethyl (3E)-2-ethyl-3-[(2-nitrobenzoyl)hydrazono]butanoate, Butyric acid, 2-ethyl-3-[(2-nitrobenzoyl)hydrazono]-, ethyl ester, ethyl (3E)-2-ethyl-3-{2-[(2-nitrophenyl)carbonyl]hydrazinylidene}butanoate
| Molecular Formula | C15H19N3O5 |
|---|---|
| Molecular Weight | 321.13 g/mol |
| LogP | 2.2898 |
| Topological Polar Surface Area | 110.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 321.13248 |
| Heavy Atoms | 23 |
| Complexity | 627.2933 |
Chemical Identifiers
| CAS Number | 314764-91-5 |
|---|---|
| SMILES | CCC(/C(=N/NC(=O)C1=CC=CC=C1[N+](=O)[O-])/C)C(=O)OCC |
Product Overview
Ethyl 2-ethyl-3-[(2-nitrobenzoyl)hydrazono]butanoate (CAS 314764-91-5), with molecular formula C15H19N3O5 and molecular weight 321.13 g/mol. IUPAC: ethyl (3E)-2-ethyl-3-[(2-nitrobenzoyl)hydrazinylidene]butanoate.
Chemical Property Profile of Ethyl 2-ethyl-3-[(2-nitrobenzoyl)hydrazono]butanoate
Property Insights of Ethyl 2-ethyl-3-[(2-nitrobenzoyl)hydrazono]butanoate
The XLogP value of 2.2898 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-ethyl-3-[(2-nitrobenzoyl)hydrazono]butanoate. The TPSA of 110.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-ethyl-3-[(2-nitrobenzoyl)hydrazono]butanoate. Following Lipinski's Rule of Five, Ethyl 2-ethyl-3-[(2-nitrobenzoyl)hydrazono]butanoate 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-ethyl-3-[(2-nitrobenzoyl)hydrazono]butanoate?
The CAS number of Ethyl 2-ethyl-3-[(2-nitrobenzoyl)hydrazono]butanoate is 314764-91-5.
What is the molecular formula of Ethyl 2-ethyl-3-[(2-nitrobenzoyl)hydrazono]butanoate?
The molecular formula of Ethyl 2-ethyl-3-[(2-nitrobenzoyl)hydrazono]butanoate is C15H19N3O5.
What is the molecular weight of Ethyl 2-ethyl-3-[(2-nitrobenzoyl)hydrazono]butanoate?
The molecular weight of Ethyl 2-ethyl-3-[(2-nitrobenzoyl)hydrazono]butanoate is 321.13 g/mol.
Where can I buy Ethyl 2-ethyl-3-[(2-nitrobenzoyl)hydrazono]butanoate?
You can request a quote for Ethyl 2-ethyl-3-[(2-nitrobenzoyl)hydrazono]butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-ethyl-3-[(2-nitrobenzoyl)hydrazono]butanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-ethyl-3-[(2-nitrobenzoyl)hydrazono]butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.