3-[2-(4-bromophenyl)-2-oxoethoxy]-4-methyl-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-6-one
Chemical Structure Depiction of
3-[2-(4-bromophenyl)-2-oxoethoxy]-4-methyl-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-6-one
3-[2-(4-bromophenyl)-2-oxoethoxy]-4-methyl-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-6-one
Compound characteristics
| Compound ID: | Y040-0721 |
| Compound Name: | 3-[2-(4-bromophenyl)-2-oxoethoxy]-4-methyl-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-6-one |
| Molecular Weight: | 427.29 |
| Molecular Formula: | C22 H19 Br O4 |
| Smiles: | Cc1c(ccc2C3CCCCC=3C(=O)Oc12)OCC(c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.4331 |
| logD: | 5.4331 |
| logSw: | -5.3663 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.326 |
| InChI Key: | LHIDCGVSDLKXRK-UHFFFAOYSA-N |