Ethyl 3-(2-(4-nitrophenyl)hydrazinylidene)butanoate
TL;DR: Ethyl 3-(2-(4-nitrophenyl)hydrazinylidene)butanoate (CAS 63467-28-7) is a chemical compound with molecular formula C12H15N3O4 and molecular weight 265.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[(4-nitrophenyl)hydrazinylidene]butanoate
Also Known As: 3-[2- hydrazono]butyricacidethylester, ethyl 3-[(4-nitrophenyl)hydrazinylidene]butanoate, Butanoic acid, 3-[(4-nitrophenyl)hydrazono]-, ethyl ester, 4-nitrophenylhydrazone of acetoacetic ethylester, Butanoic acid, 3-((4-nitrophenyl)hydrazono)-, ethyl ester
| Molecular Formula | C12H15N3O4 |
|---|---|
| Molecular Weight | 265.11 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 96.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 265.10626 |
| Heavy Atoms | 19 |
| Complexity | 343.0 |
Chemical Identifiers
| CAS Number | 63467-28-7 |
|---|---|
| SMILES | CCOC(=O)CC(=NNC1=CC=C(C=C1)[N+](=O)[O-])C |
| InChIKey | DNYHQQPGIDWVRQ-UHFFFAOYSA-N |
Product Overview
Ethyl 3-(2-(4-nitrophenyl)hydrazinylidene)butanoate (CAS 63467-28-7), with molecular formula C12H15N3O4 and molecular weight 265.11 g/mol. IUPAC: ethyl 3-[(4-nitrophenyl)hydrazinylidene]butanoate.
Chemical Property Profile of Ethyl 3-(2-(4-nitrophenyl)hydrazinylidene)butanoate
Property Insights of Ethyl 3-(2-(4-nitrophenyl)hydrazinylidene)butanoate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-(2-(4-nitrophenyl)hydrazinylidene)butanoate. The TPSA of 96.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-(2-(4-nitrophenyl)hydrazinylidene)butanoate. Following Lipinski's Rule of Five, Ethyl 3-(2-(4-nitrophenyl)hydrazinylidene)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 3-(2-(4-nitrophenyl)hydrazinylidene)butanoate?
The CAS number of Ethyl 3-(2-(4-nitrophenyl)hydrazinylidene)butanoate is 63467-28-7.
What is the molecular formula of Ethyl 3-(2-(4-nitrophenyl)hydrazinylidene)butanoate?
The molecular formula of Ethyl 3-(2-(4-nitrophenyl)hydrazinylidene)butanoate is C12H15N3O4.
What is the molecular weight of Ethyl 3-(2-(4-nitrophenyl)hydrazinylidene)butanoate?
The molecular weight of Ethyl 3-(2-(4-nitrophenyl)hydrazinylidene)butanoate is 265.11 g/mol.
Where can I buy Ethyl 3-(2-(4-nitrophenyl)hydrazinylidene)butanoate?
You can request a quote for Ethyl 3-(2-(4-nitrophenyl)hydrazinylidene)butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-(2-(4-nitrophenyl)hydrazinylidene)butanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-(2-(4-nitrophenyl)hydrazinylidene)butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.