![ethyl (4E)-4-[(4-nitrophenyl)hydrazinylidene]pentanoate structure](/static/products/5457/5457-85-2.webp)
ethyl (4E)-4-[(4-nitrophenyl)hydrazinylidene]pentanoate
TL;DR: ethyl (4E)-4-[(4-nitrophenyl)hydrazinylidene]pentanoate (CAS 5457-85-2) is a chemical compound with molecular formula C13H17N3O4 and molecular weight 279.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[(4-nitrophenyl)hydrazinylidene]pentanoate
Also Known As: Octanoic acid,cyclopentyl ester, ethyl (4E)-4-[(4-nitrophenyl)hydrazinylidene]pentanoate, ethyl 4-[(4-nitrophenyl)hydrazinylidene]pentanoate, ethyl 4-[2-(4-nitrophenyl)hydrazinylidene]pentanoate
| Molecular Formula | C13H17N3O4 |
|---|---|
| Molecular Weight | 279.12 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 96.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 279.12192 |
| Heavy Atoms | 20 |
| Complexity | 357.0 |
Chemical Identifiers
| CAS Number | 5457-85-2 |
|---|---|
| SMILES | CCOC(=O)CCC(=NNC1=CC=C(C=C1)[N+](=O)[O-])C |
| InChIKey | SNAQEOYVKJDXKG-UHFFFAOYSA-N |
Product Overview
ethyl (4E)-4-[(4-nitrophenyl)hydrazinylidene]pentanoate (CAS 5457-85-2), with molecular formula C13H17N3O4 and molecular weight 279.12 g/mol. IUPAC: ethyl 4-[(4-nitrophenyl)hydrazinylidene]pentanoate.
Chemical Property Profile of ethyl (4E)-4-[(4-nitrophenyl)hydrazinylidene]pentanoate
Property Insights of ethyl (4E)-4-[(4-nitrophenyl)hydrazinylidene]pentanoate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl (4E)-4-[(4-nitrophenyl)hydrazinylidene]pentanoate. The TPSA of 96.5 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl (4E)-4-[(4-nitrophenyl)hydrazinylidene]pentanoate. Following Lipinski's Rule of Five, ethyl (4E)-4-[(4-nitrophenyl)hydrazinylidene]pentanoate 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 (4E)-4-[(4-nitrophenyl)hydrazinylidene]pentanoate?
The CAS number of ethyl (4E)-4-[(4-nitrophenyl)hydrazinylidene]pentanoate is 5457-85-2.
What is the molecular formula of ethyl (4E)-4-[(4-nitrophenyl)hydrazinylidene]pentanoate?
The molecular formula of ethyl (4E)-4-[(4-nitrophenyl)hydrazinylidene]pentanoate is C13H17N3O4.
What is the molecular weight of ethyl (4E)-4-[(4-nitrophenyl)hydrazinylidene]pentanoate?
The molecular weight of ethyl (4E)-4-[(4-nitrophenyl)hydrazinylidene]pentanoate is 279.12 g/mol.
Where can I buy ethyl (4E)-4-[(4-nitrophenyl)hydrazinylidene]pentanoate?
You can request a quote for ethyl (4E)-4-[(4-nitrophenyl)hydrazinylidene]pentanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl (4E)-4-[(4-nitrophenyl)hydrazinylidene]pentanoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl (4E)-4-[(4-nitrophenyl)hydrazinylidene]pentanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.