Ethyl 2-cyano-2-(2-methoxyphenyl)diazenyl-acetate
TL;DR: Ethyl 2-cyano-2-(2-methoxyphenyl)diazenyl-acetate (CAS 60179-80-8) is a chemical compound with molecular formula C12H13N3O3 and molecular weight 247.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-cyano-2-[(2-methoxyphenyl)diazenyl]acetate
Also Known As: ethyl 2-cyano-2-[(2-methoxyphenyl)diazenyl]acetate, ETHYL 2-CYANO-2-(2-METHOXYPHENYL)DIAZENYL-ACETATE, Ethyl cyano[(E)-(2-methoxyphenyl)diazenyl]acetate, Acetic acid,cyano[(4-methylphenyl)azo]-,ethyl ester
| Molecular Formula | C12H13N3O3 |
|---|---|
| Molecular Weight | 247.10 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 84.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 247.09569 |
| Heavy Atoms | 18 |
| Complexity | 348.0 |
Chemical Identifiers
| CAS Number | 60179-80-8 |
|---|---|
| SMILES | CCOC(=O)C(C#N)N=NC1=CC=CC=C1OC |
| InChIKey | RNRNVACQOZFSMA-UHFFFAOYSA-N |
Product Overview
Ethyl 2-cyano-2-(2-methoxyphenyl)diazenyl-acetate (CAS 60179-80-8), with molecular formula C12H13N3O3 and molecular weight 247.10 g/mol. IUPAC: ethyl 2-cyano-2-[(2-methoxyphenyl)diazenyl]acetate.
Chemical Property Profile of Ethyl 2-cyano-2-(2-methoxyphenyl)diazenyl-acetate
Property Insights of Ethyl 2-cyano-2-(2-methoxyphenyl)diazenyl-acetate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-cyano-2-(2-methoxyphenyl)diazenyl-acetate. The TPSA of 84.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-cyano-2-(2-methoxyphenyl)diazenyl-acetate. Following Lipinski's Rule of Five, Ethyl 2-cyano-2-(2-methoxyphenyl)diazenyl-acetate has 0 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 2-cyano-2-(2-methoxyphenyl)diazenyl-acetate?
The CAS number of Ethyl 2-cyano-2-(2-methoxyphenyl)diazenyl-acetate is 60179-80-8.
What is the molecular formula of Ethyl 2-cyano-2-(2-methoxyphenyl)diazenyl-acetate?
The molecular formula of Ethyl 2-cyano-2-(2-methoxyphenyl)diazenyl-acetate is C12H13N3O3.
What is the molecular weight of Ethyl 2-cyano-2-(2-methoxyphenyl)diazenyl-acetate?
The molecular weight of Ethyl 2-cyano-2-(2-methoxyphenyl)diazenyl-acetate is 247.10 g/mol.
Where can I buy Ethyl 2-cyano-2-(2-methoxyphenyl)diazenyl-acetate?
You can request a quote for Ethyl 2-cyano-2-(2-methoxyphenyl)diazenyl-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-(2-methoxyphenyl)diazenyl-acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-cyano-2-(2-methoxyphenyl)diazenyl-acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.