butyl [(4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]acetate
Chemical Structure Depiction of
butyl [(4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]acetate
butyl [(4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]acetate
Compound characteristics
| Compound ID: | Y040-7327 |
| Compound Name: | butyl [(4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]acetate |
| Molecular Weight: | 316.35 |
| Molecular Formula: | C18 H20 O5 |
| Smiles: | CCCCOC(COc1ccc2C3CCCC=3C(=O)Oc2c1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0289 |
| logD: | 3.0289 |
| logSw: | -3.2341 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.399 |
| InChI Key: | DCAVVDOIZRDXEE-UHFFFAOYSA-N |