Ethyl cyano({6-nitro-2,3-dimethylphenyl}hydrazono)acetate
TL;DR: Ethyl cyano({6-nitro-2,3-dimethylphenyl}hydrazono)acetate (CAS 1351449-01-8) is a chemical compound with molecular formula C13H14N4O4 and molecular weight 290.1015 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl (2E)-2-cyano-2-[(2,3-dimethyl-6-nitrophenyl)hydrazinylidene]acetate
Also Known As: ethyl cyano({6-nitro-2,3-dimethylphenyl}hydrazono)acetate, AF-407/34872017, ethyl (2E)-2-cyano-2-[(2,3-dimethyl-6-nitrophenyl)hydrazinylidene]acetate
Technical Specifications
| Molecular Formula | C13H14N4O4 |
| Molecular Weight | 290.1015 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 120.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 290.1015 Da |
| Heavy Atoms | 21 |
| Complexity | 476.0 |
| SMILES | CCOC(=O)/C(=N/NC1=C(C=CC(=C1C)C)[N+](=O)[O-])/C#N |
| InChIKey | GLEZOPSTMYLJBN-XNTDXEJSSA-N |
Chemical Property Profile of Ethyl cyano({6-nitro-2,3-dimethylphenyl}hydrazono)acetate
Property Insights of Ethyl cyano({6-nitro-2,3-dimethylphenyl}hydrazono)acetate
The XLogP value of 3.8 indicates that Ethyl cyano({6-nitro-2,3-dimethylphenyl}hydrazono)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl cyano({6-nitro-2,3-dimethylphenyl}hydrazono)acetate. Following Lipinski's Rule of Five, Ethyl cyano({6-nitro-2,3-dimethylphenyl}hydrazono)acetate has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ethyl cyano({6-nitro-2,3-dimethylphenyl}hydrazono)acetate?
The CAS number of Ethyl cyano({6-nitro-2,3-dimethylphenyl}hydrazono)acetate is 1351449-01-8.
What is the molecular formula of Ethyl cyano({6-nitro-2,3-dimethylphenyl}hydrazono)acetate?
The molecular formula of Ethyl cyano({6-nitro-2,3-dimethylphenyl}hydrazono)acetate is C13H14N4O4.
What is the molecular weight of Ethyl cyano({6-nitro-2,3-dimethylphenyl}hydrazono)acetate?
The molecular weight of Ethyl cyano({6-nitro-2,3-dimethylphenyl}hydrazono)acetate is 290.1015 g/mol.
Where can I buy Ethyl cyano({6-nitro-2,3-dimethylphenyl}hydrazono)acetate?
You can request a quote for Ethyl cyano({6-nitro-2,3-dimethylphenyl}hydrazono)acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl cyano({6-nitro-2,3-dimethylphenyl}hydrazono)acetate?
Yes, CoreyChem provides custom synthesis services for Ethyl cyano({6-nitro-2,3-dimethylphenyl}hydrazono)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.