methyl 4-{[(2-chloro-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]methyl}benzoate
Chemical Structure Depiction of
methyl 4-{[(2-chloro-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]methyl}benzoate
methyl 4-{[(2-chloro-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]methyl}benzoate
Compound characteristics
| Compound ID: | 3338-2054 |
| Compound Name: | methyl 4-{[(2-chloro-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]methyl}benzoate |
| Molecular Weight: | 398.84 |
| Molecular Formula: | C22 H19 Cl O5 |
| Smiles: | COC(c1ccc(COc2cc3c(cc2[Cl])C2CCCCC=2C(=O)O3)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7675 |
| logD: | 5.7675 |
| logSw: | -5.9369 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.569 |
| InChI Key: | JLKZANYXBGEUHG-UHFFFAOYSA-N |