3-((4-Nitro-phenyl)-hydrazono)-butyric acid ethyl ester
TL;DR: 3-((4-Nitro-phenyl)-hydrazono)-butyric acid ethyl ester (CAS 6410-70-4) 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 (3E)-3-[(4-nitrophenyl)hydrazinylidene]butanoate
Also Known As: 3-[2- hydrazono]butyricacidethylester, ethyl 3-[(4-nitrophenyl)hydrazono]butanoate, 3-[2-(4-Nitrophenyl)hydrazono]butyric acid ethyl ester, Butanoic acid, 3-((4-nitrophenyl)hydrazono)-, ethyl ester, Butanoic acid, 3-(2-(4-nitrophenyl)hydrazinylidene)-, ethyl ester
| Molecular Formula | C12H15N3O4 |
|---|---|
| Molecular Weight | 265.11 g/mol |
| LogP | 2.3358 |
| Topological Polar Surface Area | 93.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 265.10626 |
| Heavy Atoms | 19 |
| Complexity | 482.25278 |
Chemical Identifiers
| CAS Number | 6410-70-4 |
|---|---|
| SMILES | CCOC(=O)C/C(=N/NC1=CC=C(C=C1)[N+](=O)[O-])/C |
Product Overview
3-((4-Nitro-phenyl)-hydrazono)-butyric acid ethyl ester (CAS 6410-70-4), with molecular formula C12H15N3O4 and molecular weight 265.11 g/mol. IUPAC: ethyl (3E)-3-[(4-nitrophenyl)hydrazinylidene]butanoate.
Chemical Property Profile of 3-((4-Nitro-phenyl)-hydrazono)-butyric acid ethyl ester
Property Insights of 3-((4-Nitro-phenyl)-hydrazono)-butyric acid ethyl ester
The XLogP value of 2.3358 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-((4-Nitro-phenyl)-hydrazono)-butyric acid ethyl ester. The TPSA of 93.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-((4-Nitro-phenyl)-hydrazono)-butyric acid ethyl ester. Following Lipinski's Rule of Five, 3-((4-Nitro-phenyl)-hydrazono)-butyric acid ethyl ester 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 3-((4-Nitro-phenyl)-hydrazono)-butyric acid ethyl ester?
The CAS number of 3-((4-Nitro-phenyl)-hydrazono)-butyric acid ethyl ester is 6410-70-4.
What is the molecular formula of 3-((4-Nitro-phenyl)-hydrazono)-butyric acid ethyl ester?
The molecular formula of 3-((4-Nitro-phenyl)-hydrazono)-butyric acid ethyl ester is C12H15N3O4.
What is the molecular weight of 3-((4-Nitro-phenyl)-hydrazono)-butyric acid ethyl ester?
The molecular weight of 3-((4-Nitro-phenyl)-hydrazono)-butyric acid ethyl ester is 265.11 g/mol.
Where can I buy 3-((4-Nitro-phenyl)-hydrazono)-butyric acid ethyl ester?
You can request a quote for 3-((4-Nitro-phenyl)-hydrazono)-butyric acid ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((4-Nitro-phenyl)-hydrazono)-butyric acid ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 3-((4-Nitro-phenyl)-hydrazono)-butyric acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.