HuagongsheHuagongshe Chemistry Print Report · For research reference only
Methyl 5-methoxy-3-oxo-2,3-dihydro-1H-indene-4-carboxylate
Methyl 6-methoxy-1-indanone-7-carboxylate · Methyl 5-Methoxy-3-oxo-2,3-dihydro-1H-indene-4-carboxylate · 5-methoxy-3-oxo-1,2-dihydroindene-4-carboxylic acid methyl ester · 2,3-dihydro-5-methoxy-3-oxo-1H-Indene-4-carboxylic acid methyl ester · 1H-Indene-4-carboxylic acid, 2,3-dihydro-5-methoxy-3-oxo-, methyl ester
Identifiers & Physical Properties
| CAS No. | 33521-63-0 |
|---|---|
| Molecular formula | C12H12O4 |
| Average molar mass | 220.22 g/mol |
| Monoisotopic mass | 220.07355886 g/mol |
| SMILES | COC(=O)c1c(OC)ccc2c1C(=O)CC2 |
| InChIKey | RZXOQELJQWGFIS-UHFFFAOYSA-N |
| PubChem CID | 12374672 |
| DTXSID | DTXSID50495023 |
Chemical & Physical Properties
| XLogP | 1.5 |
|---|---|
| Topological polar surface area | 52.6 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 3 |
| Heavy atoms | 16 |
| Formal charge | 0 |
| Complexity | 299 |
| Storage conditions | 2-8°C |