![Ethyl 2-[(2,2,2-trichloroacetyl)amino]acetate structure](/static/products/116/116963-47-4.webp)
Ethyl 2-[(2,2,2-trichloroacetyl)amino]acetate
TL;DR: Ethyl 2-[(2,2,2-trichloroacetyl)amino]acetate (CAS 116963-47-4) is a chemical compound with molecular formula C6H8Cl3NO3 and molecular weight 246.95697 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-[(2,2,2-trichloroacetyl)amino]acetate
Also Known As: Ethyl N-(trichloroacetyl)-2-aminoacetate, Ethyl 2-[(2,2,2-trichloroacetyl)amino]acetate
Technical Specifications
| Molecular Formula | C6H8Cl3NO3 |
| Molecular Weight | 246.95697 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 246.95697 Da |
| Heavy Atoms | 13 |
| Complexity | 202.0 |
| SMILES | CCOC(=O)CNC(=O)C(Cl)(Cl)Cl |
| InChIKey | MEUZBOZARPJXKO-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 2-[(2,2,2-trichloroacetyl)amino]acetate
Property Insights of Ethyl 2-[(2,2,2-trichloroacetyl)amino]acetate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-[(2,2,2-trichloroacetyl)amino]acetate. With a topological polar surface area (TPSA) of 55.4 Ų, Ethyl 2-[(2,2,2-trichloroacetyl)amino]acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-[(2,2,2-trichloroacetyl)amino]acetate has 1 hydrogen bond donor(s) and 3 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 2-[(2,2,2-trichloroacetyl)amino]acetate?
The CAS number of Ethyl 2-[(2,2,2-trichloroacetyl)amino]acetate is 116963-47-4.
What is the molecular formula of Ethyl 2-[(2,2,2-trichloroacetyl)amino]acetate?
The molecular formula of Ethyl 2-[(2,2,2-trichloroacetyl)amino]acetate is C6H8Cl3NO3.
What is the molecular weight of Ethyl 2-[(2,2,2-trichloroacetyl)amino]acetate?
The molecular weight of Ethyl 2-[(2,2,2-trichloroacetyl)amino]acetate is 246.95697 g/mol.
Where can I buy Ethyl 2-[(2,2,2-trichloroacetyl)amino]acetate?
You can request a quote for Ethyl 2-[(2,2,2-trichloroacetyl)amino]acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 2-[(2,2,2-trichloroacetyl)amino]acetate?
Yes, CoreyChem provides custom synthesis services for Ethyl 2-[(2,2,2-trichloroacetyl)amino]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.