7-methyl-9-[2-(4-methylphenyl)-2-oxoethoxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Chemical Structure Depiction of
7-methyl-9-[2-(4-methylphenyl)-2-oxoethoxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
7-methyl-9-[2-(4-methylphenyl)-2-oxoethoxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Compound characteristics
| Compound ID: | Y040-0806 |
| Compound Name: | 7-methyl-9-[2-(4-methylphenyl)-2-oxoethoxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one |
| Molecular Weight: | 348.4 |
| Molecular Formula: | C22 H20 O4 |
| Smiles: | Cc1ccc(cc1)C(COc1cc(C)cc2c1C1CCCC=1C(=O)O2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4139 |
| logD: | 4.4139 |
| logSw: | -4.6122 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.008 |
| InChI Key: | RLWJMMXNMVXKDJ-UHFFFAOYSA-N |