methyl [(8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy](phenyl)acetate
Chemical Structure Depiction of
methyl [(8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy](phenyl)acetate
methyl [(8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy](phenyl)acetate
Compound characteristics
| Compound ID: | Y040-1290 |
| Compound Name: | methyl [(8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy](phenyl)acetate |
| Molecular Weight: | 384.81 |
| Molecular Formula: | C21 H17 Cl O5 |
| Smiles: | COC(C(c1ccccc1)Oc1cc2c(cc1[Cl])C1CCCC=1C(=O)O2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.837 |
| logD: | 4.837 |
| logSw: | -5.0224 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.211 |
| InChI Key: | ZAMCYKJZYMOBPX-LJQANCHMSA-N |