HuagongsheHuagongshe Chemistry Print Report · For research reference only
diethyl 1-(2-azidoethyl)-1H-pyrrole-2,4-dicarboxylate
Identifiers & Physical Properties
| Molecular formula | C12H16N4O4 |
|---|---|
| Average molar mass | 280.28 g/mol |
| Monoisotopic mass | 280.117155 g/mol |
| SMILES | CCOC(=O)c1cc(C(=O)OCC)n(CCN=[N+]=[N-])c1 |
| InChIKey | UOSTWBRROKKWNI-UHFFFAOYSA-N |
| PubChem CID | 57517455 |
Chemical & Physical Properties
| XLogP | 2.3 |
|---|---|
| Topological polar surface area | 71.9 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 6 |
| Rotatable bonds | 9 |
| Heavy atoms | 20 |
| Formal charge | 0 |
| Complexity | 395 |