HuagongsheHuagongshe Chemistry Print Report · For research reference only
Methyl 2,5-dimethyl-1H-pyrrole-1-carboxylate

Identifiers & Physical Properties
| CAS No. | 5044-30-4 |
|---|---|
| Molecular formula | C8H11NO2 |
| Average molar mass | 153.18 g/mol |
| Monoisotopic mass | 153.07897859 g/mol |
| SMILES | COC(=O)n1c(C)ccc1C |
| InChIKey | YRTOCIAZPCWZPU-UHFFFAOYSA-N |
| PubChem CID | 12374590 |
| DTXSID | DTXSID90495007 |
Chemical & Physical Properties
| XLogP | 1.7 |
|---|---|
| Topological polar surface area | 31.2 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 1 |
| Heavy atoms | 11 |
| Formal charge | 0 |
| Complexity | 148 |