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Methyl 4-[(2-ethoxy-2-oxoethyl)amino]-4-oxobutanoate
TL;DR: Methyl 4-[(2-ethoxy-2-oxoethyl)amino]-4-oxobutanoate (CAS 500575-46-2) is a chemical compound with molecular formula C9H15NO5 and molecular weight 217.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(2-ethoxy-2-oxoethyl)amino]-4-oxobutanoate
Also Known As: methyl 4-[(2-ethoxy-2-oxoethyl)amino]-4-oxobutanoate, methyl 3-[(2-ethoxy-2-oxoethyl)carbamoyl]propanoate
| Molecular Formula | C9H15NO5 |
|---|---|
| Molecular Weight | 217.10 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 217.09502 |
| Heavy Atoms | 15 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 500575-46-2 |
|---|---|
| SMILES | CCOC(=O)CNC(=O)CCC(=O)OC |
| InChIKey | JOUWOTVJKIENBZ-UHFFFAOYSA-N |
Product Overview
Methyl 4-[(2-ethoxy-2-oxoethyl)amino]-4-oxobutanoate (CAS 500575-46-2), with molecular formula C9H15NO5 and molecular weight 217.10 g/mol. IUPAC: methyl 4-[(2-ethoxy-2-oxoethyl)amino]-4-oxobutanoate.
Chemical Property Profile of Methyl 4-[(2-ethoxy-2-oxoethyl)amino]-4-oxobutanoate
Property Insights of Methyl 4-[(2-ethoxy-2-oxoethyl)amino]-4-oxobutanoate
The XLogP value of -0.4 indicates that Methyl 4-[(2-ethoxy-2-oxoethyl)amino]-4-oxobutanoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-[(2-ethoxy-2-oxoethyl)amino]-4-oxobutanoate. Following Lipinski's Rule of Five, Methyl 4-[(2-ethoxy-2-oxoethyl)amino]-4-oxobutanoate has 1 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 Methyl 4-[(2-ethoxy-2-oxoethyl)amino]-4-oxobutanoate?
The CAS number of Methyl 4-[(2-ethoxy-2-oxoethyl)amino]-4-oxobutanoate is 500575-46-2.
What is the molecular formula of Methyl 4-[(2-ethoxy-2-oxoethyl)amino]-4-oxobutanoate?
The molecular formula of Methyl 4-[(2-ethoxy-2-oxoethyl)amino]-4-oxobutanoate is C9H15NO5.
What is the molecular weight of Methyl 4-[(2-ethoxy-2-oxoethyl)amino]-4-oxobutanoate?
The molecular weight of Methyl 4-[(2-ethoxy-2-oxoethyl)amino]-4-oxobutanoate is 217.10 g/mol.
Where can I buy Methyl 4-[(2-ethoxy-2-oxoethyl)amino]-4-oxobutanoate?
You can request a quote for Methyl 4-[(2-ethoxy-2-oxoethyl)amino]-4-oxobutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-[(2-ethoxy-2-oxoethyl)amino]-4-oxobutanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-[(2-ethoxy-2-oxoethyl)amino]-4-oxobutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.