Ethyl 2-cyano-2-(hydroxyimino)acetate
TL;DR: Ethyl 2-cyano-2-(hydroxyimino)acetate (CAS 89765-49-1) is a chemical compound with molecular formula C5H6N2O3 and molecular weight 142.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-cyano-2-hydroxyiminoacetate
Also Known As: Ethyl cyanoglyoxylate-2-oxime, Oxyma, OxymaPure, Ethyl 2-cyano-2-(hydroxyimino)acetate, Ethyl (hydroxyimino)cyanoacetate
| Molecular Formula | C5H6N2O3 |
|---|---|
| Molecular Weight | 142.04 g/mol |
| LogP | -0.09672 |
| Topological Polar Surface Area | 82.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 142.03784 |
| Heavy Atoms | 10 |
| Complexity | 191.55997 |
Chemical Identifiers
| CAS Number | 89765-49-1 |
|---|---|
| SMILES | CCOC(=O)C(=NO)C#N |
Product Overview
Ethyl 2-cyano-2-(hydroxyimino)acetate (CAS 89765-49-1), with molecular formula C5H6N2O3 and molecular weight 142.04 g/mol. IUPAC: ethyl 2-cyano-2-hydroxyiminoacetate.
Chemical Property Profile of Ethyl 2-cyano-2-(hydroxyimino)acetate
Property Insights of Ethyl 2-cyano-2-(hydroxyimino)acetate
The XLogP value of -0.09672 indicates that Ethyl 2-cyano-2-(hydroxyimino)acetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 82.68 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-cyano-2-(hydroxyimino)acetate. Following Lipinski's Rule of Five, Ethyl 2-cyano-2-(hydroxyimino)acetate has 1 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 2-cyano-2-(hydroxyimino)acetate?
The CAS number of Ethyl 2-cyano-2-(hydroxyimino)acetate is 89765-49-1.
What is the molecular formula of Ethyl 2-cyano-2-(hydroxyimino)acetate?
The molecular formula of Ethyl 2-cyano-2-(hydroxyimino)acetate is C5H6N2O3.
What is the molecular weight of Ethyl 2-cyano-2-(hydroxyimino)acetate?
The molecular weight of Ethyl 2-cyano-2-(hydroxyimino)acetate is 142.04 g/mol.
Where can I buy Ethyl 2-cyano-2-(hydroxyimino)acetate?
You can request a quote for Ethyl 2-cyano-2-(hydroxyimino)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-cyano-2-(hydroxyimino)acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-cyano-2-(hydroxyimino)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.