9-[2-(3-methoxyphenyl)-2-oxoethoxy]-7-methyl-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Chemical Structure Depiction of
9-[2-(3-methoxyphenyl)-2-oxoethoxy]-7-methyl-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
9-[2-(3-methoxyphenyl)-2-oxoethoxy]-7-methyl-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Compound characteristics
| Compound ID: | Y040-0813 |
| Compound Name: | 9-[2-(3-methoxyphenyl)-2-oxoethoxy]-7-methyl-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one |
| Molecular Weight: | 364.4 |
| Molecular Formula: | C22 H20 O5 |
| Smiles: | Cc1cc(c2C3CCCC=3C(=O)Oc2c1)OCC(c1cccc(c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2878 |
| logD: | 4.2878 |
| logSw: | -4.648 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.552 |
| InChI Key: | DKOIQGMCLGNCHS-UHFFFAOYSA-N |