4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl 3-methoxybenzoate
Chemical Structure Depiction of
4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl 3-methoxybenzoate
4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl 3-methoxybenzoate
Compound characteristics
| Compound ID: | Y040-1242 |
| Compound Name: | 4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl 3-methoxybenzoate |
| Molecular Weight: | 336.34 |
| Molecular Formula: | C20 H16 O5 |
| Smiles: | COc1cccc(c1)C(=O)Oc1ccc2C3CCCC=3C(=O)Oc2c1 |
| Stereo: | ACHIRAL |
| logP: | 3.3971 |
| logD: | 3.3971 |
| logSw: | -3.7346 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.368 |
| InChI Key: | BYNAQMSXJXRJGI-UHFFFAOYSA-N |