Diethyl 2,2'-(ethylimino)diacetate
TL;DR: Diethyl 2,2'-(ethylimino)diacetate (CAS 91017-42-4) is a chemical compound with molecular formula C10H19NO4 and molecular weight 217.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(2-ethoxy-2-oxoethyl)-ethylamino]acetate
Also Known As: diethyl 2,2'-(ethylimino)diacetate, NCIOpen2_007187, Diethyl 2,2'-(ethylazanediyl)diacetate, ethyl 2-[(2-ethoxy-2-oxoethyl)-ethylamino]acetate
| Molecular Formula | C10H19NO4 |
|---|---|
| Molecular Weight | 217.13 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 217.13141 |
| Heavy Atoms | 15 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 91017-42-4 |
|---|---|
| SMILES | CCN(CC(=O)OCC)CC(=O)OCC |
| InChIKey | DGOYJFOQFYMNHH-UHFFFAOYSA-N |
Product Overview
Diethyl 2,2'-(ethylimino)diacetate (CAS 91017-42-4), with molecular formula C10H19NO4 and molecular weight 217.13 g/mol. IUPAC: ethyl 2-[(2-ethoxy-2-oxoethyl)-ethylamino]acetate.
Chemical Property Profile of Diethyl 2,2'-(ethylimino)diacetate
Property Insights of Diethyl 2,2'-(ethylimino)diacetate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl 2,2'-(ethylimino)diacetate. With a topological polar surface area (TPSA) of 55.8 Ų, Diethyl 2,2'-(ethylimino)diacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethyl 2,2'-(ethylimino)diacetate has 0 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 Diethyl 2,2'-(ethylimino)diacetate?
The CAS number of Diethyl 2,2'-(ethylimino)diacetate is 91017-42-4.
What is the molecular formula of Diethyl 2,2'-(ethylimino)diacetate?
The molecular formula of Diethyl 2,2'-(ethylimino)diacetate is C10H19NO4.
What is the molecular weight of Diethyl 2,2'-(ethylimino)diacetate?
The molecular weight of Diethyl 2,2'-(ethylimino)diacetate is 217.13 g/mol.
Where can I buy Diethyl 2,2'-(ethylimino)diacetate?
You can request a quote for Diethyl 2,2'-(ethylimino)diacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 2,2'-(ethylimino)diacetate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 2,2'-(ethylimino)diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.