HuagongsheHuagongshe Chemistry Print Report · For research reference only
Ethyl 1-acetyl-4-oxopyrrolidine-3-carboxylate
Identifiers & Physical Properties
| CAS No. | 2181-33-1 |
|---|---|
| Molecular formula | C9H13NO4 |
| Average molar mass | 199.2 g/mol |
| Monoisotopic mass | 199.0844579 g/mol |
| SMILES | CCOC(=O)C1CN(C(C)=O)CC1=O |
| InChIKey | KHFQTWZABTWLRK-UHFFFAOYSA-N |
| PubChem CID | 323504 |
| DTXSID | DTXSID50314482 |
Chemical & Physical Properties
| XLogP | -0.2 |
|---|---|
| Topological polar surface area | 63.7 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 3 |
| Heavy atoms | 14 |
| Formal charge | 0 |
| Complexity | 274 |