8-chloro-7-[(3-oxobutan-2-yl)oxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Chemical Structure Depiction of
8-chloro-7-[(3-oxobutan-2-yl)oxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
8-chloro-7-[(3-oxobutan-2-yl)oxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Compound characteristics
| Compound ID: | 4790-1255 |
| Compound Name: | 8-chloro-7-[(3-oxobutan-2-yl)oxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one |
| Molecular Weight: | 306.74 |
| Molecular Formula: | C16 H15 Cl O4 |
| Smiles: | CC(C(C)=O)Oc1cc2c(cc1[Cl])C1CCCC=1C(=O)O2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5949 |
| logD: | 3.5949 |
| logSw: | -3.823 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.149 |
| InChI Key: | SABSSOHFOJCLKS-VIFPVBQESA-N |