HuagongsheHuagongshe Chemistry Print Report · For research reference only
Methyl inden-3-ylacetate

Identifiers & Physical Properties
| CAS No. | 121929-95-1 |
|---|---|
| Molecular formula | C12H12O2 |
| Average molar mass | 188.22 g/mol |
| Monoisotopic mass | 188.08372962 g/mol |
| SMILES | COC(=O)CC1=CCc2ccccc21 |
| InChIKey | PASIDZJGOCPTGW-UHFFFAOYSA-N |
| PubChem CID | 14316632 |
| DTXSID | DTXSID001311460 |
Chemical & Physical Properties
| XLogP | 2.1 |
|---|---|
| Topological polar surface area | 26.3 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 3 |
| Heavy atoms | 14 |
| Formal charge | 0 |
| Complexity | 255 |