7-[2-(4-methylphenyl)-2-oxoethoxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Chemical Structure Depiction of
7-[2-(4-methylphenyl)-2-oxoethoxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
7-[2-(4-methylphenyl)-2-oxoethoxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Compound characteristics
| Compound ID: | Y041-9846 |
| Compound Name: | 7-[2-(4-methylphenyl)-2-oxoethoxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one |
| Molecular Weight: | 334.37 |
| Molecular Formula: | C21 H18 O4 |
| Smiles: | Cc1ccc(cc1)C(COc1ccc2C3CCCC=3C(=O)Oc2c1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6929 |
| logD: | 3.6929 |
| logSw: | -3.9703 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.921 |
| InChI Key: | BNXHSUHAWSGEAQ-UHFFFAOYSA-N |