ethyl (2E)-3-imino-2-(phenylhydrazinylidene)butanoate
TL;DR: ethyl (2E)-3-imino-2-(phenylhydrazinylidene)butanoate (CAS 77362-58-4) is a chemical compound with molecular formula C12H15N3O2 and molecular weight 233.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2E)-3-imino-2-(phenylhydrazinylidene)butanoate
Also Known As: 3-Amino-2-phenylazo-2-butensaeureethylester, ethyl (2E)-3-imino-2-(phenylhydrazinylidene)butanoate
| Molecular Formula | C12H15N3O2 |
|---|---|
| Molecular Weight | 233.12 g/mol |
| LogP | 2.05727 |
| Topological Polar Surface Area | 74.54 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 233.11642 |
| Heavy Atoms | 17 |
| Complexity | 426.6367 |
Chemical Identifiers
| CAS Number | 77362-58-4 |
|---|---|
| SMILES | CCOC(=O)/C(=N/NC1=CC=CC=C1)/C(=N)C |
Product Overview
ethyl (2E)-3-imino-2-(phenylhydrazinylidene)butanoate (CAS 77362-58-4), with molecular formula C12H15N3O2 and molecular weight 233.12 g/mol. IUPAC: ethyl (2E)-3-imino-2-(phenylhydrazinylidene)butanoate.
Chemical Property Profile of ethyl (2E)-3-imino-2-(phenylhydrazinylidene)butanoate
Property Insights of ethyl (2E)-3-imino-2-(phenylhydrazinylidene)butanoate
The XLogP value of 2.05727 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl (2E)-3-imino-2-(phenylhydrazinylidene)butanoate. The TPSA of 74.54 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl (2E)-3-imino-2-(phenylhydrazinylidene)butanoate. Following Lipinski's Rule of Five, ethyl (2E)-3-imino-2-(phenylhydrazinylidene)butanoate has 2 hydrogen bond donor(s) and 5 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 (2E)-3-imino-2-(phenylhydrazinylidene)butanoate?
The CAS number of ethyl (2E)-3-imino-2-(phenylhydrazinylidene)butanoate is 77362-58-4.
What is the molecular formula of ethyl (2E)-3-imino-2-(phenylhydrazinylidene)butanoate?
The molecular formula of ethyl (2E)-3-imino-2-(phenylhydrazinylidene)butanoate is C12H15N3O2.
What is the molecular weight of ethyl (2E)-3-imino-2-(phenylhydrazinylidene)butanoate?
The molecular weight of ethyl (2E)-3-imino-2-(phenylhydrazinylidene)butanoate is 233.12 g/mol.
Where can I buy ethyl (2E)-3-imino-2-(phenylhydrazinylidene)butanoate?
You can request a quote for ethyl (2E)-3-imino-2-(phenylhydrazinylidene)butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl (2E)-3-imino-2-(phenylhydrazinylidene)butanoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl (2E)-3-imino-2-(phenylhydrazinylidene)butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.