methyl [(4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy](phenyl)acetate
Chemical Structure Depiction of
methyl [(4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy](phenyl)acetate
methyl [(4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy](phenyl)acetate
Compound characteristics
| Compound ID: | Y040-1229 |
| Compound Name: | methyl [(4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy](phenyl)acetate |
| Molecular Weight: | 350.37 |
| Molecular Formula: | C21 H18 O5 |
| Smiles: | COC(C(c1ccccc1)Oc1ccc2C3CCCC=3C(=O)Oc2c1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7511 |
| logD: | 3.7511 |
| logSw: | -4.065 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.124 |
| InChI Key: | VKHUWOILVPCTQV-LJQANCHMSA-N |