Ethyl 2-(2-(4-nitrophenyl)diazenyl)-3-oxobutanoate
TL;DR: Ethyl 2-(2-(4-nitrophenyl)diazenyl)-3-oxobutanoate (CAS 33165-46-7) is a chemical compound with molecular formula C12H13N3O5 and molecular weight 279.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(4-nitrophenyl)diazenyl]-3-oxobutanoate
Also Known As: ethyl 2-((4-nitrophenyl)diazenyl)-3-oxobutanoate, ethyl 2-[(4-nitrophenyl)diazenyl]-3-oxobutanoate, Ethyl 2-[2-(4-nitrophenyl)diazenyl]-3-oxobutanoate, Ethyl 2-(2-(4-nitrophenyl)diazenyl)-3-oxobutanoate, RefChem:342361
| Molecular Formula | C12H13N3O5 |
|---|---|
| Molecular Weight | 279.09 g/mol |
| LogP | 2.1992 |
| Topological Polar Surface Area | 111.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 279.0855 |
| Heavy Atoms | 20 |
| Complexity | 538.5287 |
Chemical Identifiers
| CAS Number | 33165-46-7 |
|---|---|
| SMILES | CCOC(=O)C(C(=O)C)N=NC1=CC=C(C=C1)[N+](=O)[O-] |
Product Overview
Ethyl 2-(2-(4-nitrophenyl)diazenyl)-3-oxobutanoate (CAS 33165-46-7), with molecular formula C12H13N3O5 and molecular weight 279.09 g/mol. IUPAC: ethyl 2-[(4-nitrophenyl)diazenyl]-3-oxobutanoate.
Chemical Property Profile of Ethyl 2-(2-(4-nitrophenyl)diazenyl)-3-oxobutanoate
Property Insights of Ethyl 2-(2-(4-nitrophenyl)diazenyl)-3-oxobutanoate
The XLogP value of 2.1992 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-(2-(4-nitrophenyl)diazenyl)-3-oxobutanoate. The TPSA of 111.23 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-(2-(4-nitrophenyl)diazenyl)-3-oxobutanoate. Following Lipinski's Rule of Five, Ethyl 2-(2-(4-nitrophenyl)diazenyl)-3-oxobutanoate has 0 hydrogen bond donor(s) and 7 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-(2-(4-nitrophenyl)diazenyl)-3-oxobutanoate?
The CAS number of Ethyl 2-(2-(4-nitrophenyl)diazenyl)-3-oxobutanoate is 33165-46-7.
What is the molecular formula of Ethyl 2-(2-(4-nitrophenyl)diazenyl)-3-oxobutanoate?
The molecular formula of Ethyl 2-(2-(4-nitrophenyl)diazenyl)-3-oxobutanoate is C12H13N3O5.
What is the molecular weight of Ethyl 2-(2-(4-nitrophenyl)diazenyl)-3-oxobutanoate?
The molecular weight of Ethyl 2-(2-(4-nitrophenyl)diazenyl)-3-oxobutanoate is 279.09 g/mol.
Where can I buy Ethyl 2-(2-(4-nitrophenyl)diazenyl)-3-oxobutanoate?
You can request a quote for Ethyl 2-(2-(4-nitrophenyl)diazenyl)-3-oxobutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-(2-(4-nitrophenyl)diazenyl)-3-oxobutanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(2-(4-nitrophenyl)diazenyl)-3-oxobutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.