3-methoxy-4-{[3-(trifluoromethyl)phenyl]methoxy}-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-6-one
Chemical Structure Depiction of
3-methoxy-4-{[3-(trifluoromethyl)phenyl]methoxy}-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-6-one
3-methoxy-4-{[3-(trifluoromethyl)phenyl]methoxy}-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-6-one
Compound characteristics
| Compound ID: | Y041-1752 |
| Compound Name: | 3-methoxy-4-{[3-(trifluoromethyl)phenyl]methoxy}-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-6-one |
| Molecular Weight: | 404.38 |
| Molecular Formula: | C22 H19 F3 O4 |
| Smiles: | COc1ccc2C3CCCCC=3C(=O)Oc2c1OCc1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 5.5028 |
| logD: | 5.5028 |
| logSw: | -5.5717 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 35.796 |
| InChI Key: | DMQSDWMRVLQZHQ-UHFFFAOYSA-N |