diethyl acetamidomethylenemalonate
TL;DR: diethyl acetamidomethylenemalonate (CAS 53676-35-0) is a chemical compound with molecular formula C10H15NO5 and molecular weight 229.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-(acetamidomethylidene)propanedioate
Also Known As: diethyl acetamidomethylenemalonate, diethyl [(acetylamino)methylidene]propanedioate, diethyl 2-(acetamidomethylidene)propanedioate, Diethyl (acetamidomethylidene)propanedioate, Propanedioic acid, [(acetylamino)methylene]-, diethyl ester
| Molecular Formula | C10H15NO5 |
|---|---|
| Molecular Weight | 229.10 g/mol |
| LogP | 0.1326 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 229.09502 |
| Heavy Atoms | 16 |
| Complexity | 288.33124 |
Chemical Identifiers
| CAS Number | 53676-35-0 |
|---|---|
| SMILES | CCOC(=O)C(=CNC(=O)C)C(=O)OCC |
Product Overview
diethyl acetamidomethylenemalonate (CAS 53676-35-0), with molecular formula C10H15NO5 and molecular weight 229.10 g/mol. IUPAC: diethyl 2-(acetamidomethylidene)propanedioate.
Chemical Property Profile of diethyl acetamidomethylenemalonate
Property Insights of diethyl acetamidomethylenemalonate
The XLogP value of 0.1326 suggests moderate lipophilicity, balancing water solubility and membrane permeability for diethyl acetamidomethylenemalonate. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for diethyl acetamidomethylenemalonate. Following Lipinski's Rule of Five, diethyl acetamidomethylenemalonate 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 diethyl acetamidomethylenemalonate?
The CAS number of diethyl acetamidomethylenemalonate is 53676-35-0.
What is the molecular formula of diethyl acetamidomethylenemalonate?
The molecular formula of diethyl acetamidomethylenemalonate is C10H15NO5.
What is the molecular weight of diethyl acetamidomethylenemalonate?
The molecular weight of diethyl acetamidomethylenemalonate is 229.10 g/mol.
Where can I buy diethyl acetamidomethylenemalonate?
You can request a quote for diethyl acetamidomethylenemalonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for diethyl acetamidomethylenemalonate?
Yes, KEHONG BIO provides custom synthesis services for diethyl acetamidomethylenemalonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.