6-chloro-4-ethyl-2-oxo-2H-1-benzopyran-7-yl 4-methoxybenzoate
Chemical Structure Depiction of
6-chloro-4-ethyl-2-oxo-2H-1-benzopyran-7-yl 4-methoxybenzoate
6-chloro-4-ethyl-2-oxo-2H-1-benzopyran-7-yl 4-methoxybenzoate
Compound characteristics
| Compound ID: | Y040-2088 |
| Compound Name: | 6-chloro-4-ethyl-2-oxo-2H-1-benzopyran-7-yl 4-methoxybenzoate |
| Molecular Weight: | 358.78 |
| Molecular Formula: | C19 H15 Cl O5 |
| Smiles: | CCC1=CC(=O)Oc2cc(c(cc12)[Cl])OC(c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2735 |
| logD: | 4.2735 |
| logSw: | -4.6212 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.654 |
| InChI Key: | FHTPAGXHXAETAU-UHFFFAOYSA-N |