Ethyl 1-acetyl-5-oxopyrrolidine-2-carboxylate
TL;DR: Ethyl 1-acetyl-5-oxopyrrolidine-2-carboxylate (CAS 1315051-65-0) is a chemical compound with molecular formula C9H13NO4 and molecular weight 199.08446 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 1-acetyl-5-oxopyrrolidine-2-carboxylate
Also Known As: ethyl 1-acetyl-5-oxopyrrolidine-2-carboxylate, (R)-5-Ethylcarboxyl-N-acetyl-2-pyrrolidinone, Ethyl 1-acetyl-5-oxo-pyrrolidine-2-carboxylate
Technical Specifications
| Molecular Formula | C9H13NO4 |
| Molecular Weight | 199.08446 g/mol |
| XLogP | -0.1 |
| Topological Polar Surface Area (TPSA) | 63.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 199.08446 Da |
| Heavy Atoms | 14 |
| Complexity | 274.0 |
| SMILES | CCOC(=O)C1CCC(=O)N1C(=O)C |
| InChIKey | XWRQGBRYBZQVKD-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 1-acetyl-5-oxopyrrolidine-2-carboxylate
Property Insights of Ethyl 1-acetyl-5-oxopyrrolidine-2-carboxylate
The XLogP value of -0.1 indicates that Ethyl 1-acetyl-5-oxopyrrolidine-2-carboxylate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 63.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 1-acetyl-5-oxopyrrolidine-2-carboxylate. Following Lipinski's Rule of Five, Ethyl 1-acetyl-5-oxopyrrolidine-2-carboxylate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ethyl 1-acetyl-5-oxopyrrolidine-2-carboxylate?
The CAS number of Ethyl 1-acetyl-5-oxopyrrolidine-2-carboxylate is 1315051-65-0.
What is the molecular formula of Ethyl 1-acetyl-5-oxopyrrolidine-2-carboxylate?
The molecular formula of Ethyl 1-acetyl-5-oxopyrrolidine-2-carboxylate is C9H13NO4.
What is the molecular weight of Ethyl 1-acetyl-5-oxopyrrolidine-2-carboxylate?
The molecular weight of Ethyl 1-acetyl-5-oxopyrrolidine-2-carboxylate is 199.08446 g/mol.
Where can I buy Ethyl 1-acetyl-5-oxopyrrolidine-2-carboxylate?
You can request a quote for Ethyl 1-acetyl-5-oxopyrrolidine-2-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 1-acetyl-5-oxopyrrolidine-2-carboxylate?
Yes, CoreyChem provides custom synthesis services for Ethyl 1-acetyl-5-oxopyrrolidine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.