Ethyl 3-[ethoxycarbonyl-(2-ethoxy-2-oxoethyl)amino]propanoate
TL;DR: Ethyl 3-[ethoxycarbonyl-(2-ethoxy-2-oxoethyl)amino]propanoate (CAS 14891-08-8) is a chemical compound with molecular formula C12H21NO6 and molecular weight 275.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[ethoxycarbonyl-(2-ethoxy-2-oxoethyl)amino]propanoate
Also Known As: ethyl 3-[ethoxycarbonyl-(2-ethoxy-2-oxoethyl)amino]propanoate, ethyl 3-[(ethoxycarbonyl)(2-ethoxy-2-oxoethyl)amino]propanoate, Ethyl 3-((2-ethoxy-2-oxoethyl)(ethoxycarbonyl)amino)propanoate, ethyl N-(ethoxycarbonyl)-N-(2-ethoxy-2-oxoethyl)-beta-alaninate, b-Alanine,N-(ethoxycarbonyl)-N-(2-ethoxy-2-oxoethyl)-, ethyl ester
| Molecular Formula | C12H21NO6 |
|---|---|
| Molecular Weight | 275.14 g/mol |
| LogP | 0.9612 |
| Topological Polar Surface Area | 82.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 275.1369 |
| Heavy Atoms | 19 |
| Complexity | 304.59473 |
Chemical Identifiers
| CAS Number | 14891-08-8 |
|---|---|
| SMILES | CCOC(=O)CCN(CC(=O)OCC)C(=O)OCC |
Product Overview
Ethyl 3-[ethoxycarbonyl-(2-ethoxy-2-oxoethyl)amino]propanoate (CAS 14891-08-8), with molecular formula C12H21NO6 and molecular weight 275.14 g/mol. IUPAC: ethyl 3-[ethoxycarbonyl-(2-ethoxy-2-oxoethyl)amino]propanoate.
Chemical Property Profile of Ethyl 3-[ethoxycarbonyl-(2-ethoxy-2-oxoethyl)amino]propanoate
Property Insights of Ethyl 3-[ethoxycarbonyl-(2-ethoxy-2-oxoethyl)amino]propanoate
The XLogP value of 0.9612 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-[ethoxycarbonyl-(2-ethoxy-2-oxoethyl)amino]propanoate. The TPSA of 82.14 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-[ethoxycarbonyl-(2-ethoxy-2-oxoethyl)amino]propanoate. Following Lipinski's Rule of Five, Ethyl 3-[ethoxycarbonyl-(2-ethoxy-2-oxoethyl)amino]propanoate 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 3-[ethoxycarbonyl-(2-ethoxy-2-oxoethyl)amino]propanoate?
The CAS number of Ethyl 3-[ethoxycarbonyl-(2-ethoxy-2-oxoethyl)amino]propanoate is 14891-08-8.
What is the molecular formula of Ethyl 3-[ethoxycarbonyl-(2-ethoxy-2-oxoethyl)amino]propanoate?
The molecular formula of Ethyl 3-[ethoxycarbonyl-(2-ethoxy-2-oxoethyl)amino]propanoate is C12H21NO6.
What is the molecular weight of Ethyl 3-[ethoxycarbonyl-(2-ethoxy-2-oxoethyl)amino]propanoate?
The molecular weight of Ethyl 3-[ethoxycarbonyl-(2-ethoxy-2-oxoethyl)amino]propanoate is 275.14 g/mol.
Where can I buy Ethyl 3-[ethoxycarbonyl-(2-ethoxy-2-oxoethyl)amino]propanoate?
You can request a quote for Ethyl 3-[ethoxycarbonyl-(2-ethoxy-2-oxoethyl)amino]propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-[ethoxycarbonyl-(2-ethoxy-2-oxoethyl)amino]propanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-[ethoxycarbonyl-(2-ethoxy-2-oxoethyl)amino]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.