![Diethyl 2-{[(2-methoxy-2-oxoethyl)amino]methylene}malonate structure](/static/products/2046/204643-48-1.webp)
Diethyl 2-{[(2-methoxy-2-oxoethyl)amino]methylene}malonate
TL;DR: Diethyl 2-{[(2-methoxy-2-oxoethyl)amino]methylene}malonate (CAS 204643-48-1) is a chemical compound with molecular formula C11H17NO6 and molecular weight 259.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-[[(2-methoxy-2-oxoethyl)amino]methylidene]propanedioate
Also Known As: diethyl 2-{[(2-methoxy-2-oxoethyl)amino]methylene}malonate, 1,3-diethyl 2-{[(2-methoxy-2-oxoethyl)amino]methylidene}propanedioate, diethyl 2-[[(2-methoxy-2-oxoethyl)amino]methylidene]propanedioate, methyl N-[2,2-bis(ethoxycarbonyl)ethenyl]glycinate, diethyl 2-[[(2-methoxy-2-oxo-ethyl)amino]methylene]propanedioate
| Molecular Formula | C11H17NO6 |
|---|---|
| Molecular Weight | 259.11 g/mol |
| LogP | -0.2409 |
| Topological Polar Surface Area | 90.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 259.1056 |
| Heavy Atoms | 18 |
| Complexity | 316.42514 |
Chemical Identifiers
| CAS Number | 204643-48-1 |
|---|---|
| SMILES | CCOC(=O)C(=CNCC(=O)OC)C(=O)OCC |
Product Overview
Diethyl 2-{[(2-methoxy-2-oxoethyl)amino]methylene}malonate (CAS 204643-48-1), with molecular formula C11H17NO6 and molecular weight 259.11 g/mol. IUPAC: diethyl 2-[[(2-methoxy-2-oxoethyl)amino]methylidene]propanedioate.
Chemical Property Profile of Diethyl 2-{[(2-methoxy-2-oxoethyl)amino]methylene}malonate
Property Insights of Diethyl 2-{[(2-methoxy-2-oxoethyl)amino]methylene}malonate
The XLogP value of -0.2409 indicates that Diethyl 2-{[(2-methoxy-2-oxoethyl)amino]methylene}malonate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 90.93 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 2-{[(2-methoxy-2-oxoethyl)amino]methylene}malonate. Following Lipinski's Rule of Five, Diethyl 2-{[(2-methoxy-2-oxoethyl)amino]methylene}malonate 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
Frequently Asked Questions
What is the CAS number of Diethyl 2-{[(2-methoxy-2-oxoethyl)amino]methylene}malonate?
The CAS number of Diethyl 2-{[(2-methoxy-2-oxoethyl)amino]methylene}malonate is 204643-48-1.
What is the molecular formula of Diethyl 2-{[(2-methoxy-2-oxoethyl)amino]methylene}malonate?
The molecular formula of Diethyl 2-{[(2-methoxy-2-oxoethyl)amino]methylene}malonate is C11H17NO6.
What is the molecular weight of Diethyl 2-{[(2-methoxy-2-oxoethyl)amino]methylene}malonate?
The molecular weight of Diethyl 2-{[(2-methoxy-2-oxoethyl)amino]methylene}malonate is 259.11 g/mol.
Where can I buy Diethyl 2-{[(2-methoxy-2-oxoethyl)amino]methylene}malonate?
You can request a quote for Diethyl 2-{[(2-methoxy-2-oxoethyl)amino]methylene}malonate 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-methoxy-2-oxoethyl)amino]methylene}malonate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 2-{[(2-methoxy-2-oxoethyl)amino]methylene}malonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.