9-hydroxy-7-methyl-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Chemical Structure Depiction of
9-hydroxy-7-methyl-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
9-hydroxy-7-methyl-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Compound characteristics
| Compound ID: | Y040-6807 |
| Compound Name: | 9-hydroxy-7-methyl-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one |
| Molecular Weight: | 216.23 |
| Molecular Formula: | C13 H12 O3 |
| Smiles: | Cc1cc(c2C3CCCC=3C(=O)Oc2c1)O |
| Stereo: | ACHIRAL |
| logP: | 2.767 |
| logD: | 2.7061 |
| logSw: | -2.5714 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.995 |
| InChI Key: | XUKMRKKFRWRLJF-UHFFFAOYSA-N |