benzyl [(6-chloro-2-oxo-4-propyl-2H-1-benzopyran-7-yl)oxy]acetate
Chemical Structure Depiction of
benzyl [(6-chloro-2-oxo-4-propyl-2H-1-benzopyran-7-yl)oxy]acetate
benzyl [(6-chloro-2-oxo-4-propyl-2H-1-benzopyran-7-yl)oxy]acetate
Compound characteristics
| Compound ID: | Y040-0092 |
| Compound Name: | benzyl [(6-chloro-2-oxo-4-propyl-2H-1-benzopyran-7-yl)oxy]acetate |
| Molecular Weight: | 386.83 |
| Molecular Formula: | C21 H19 Cl O5 |
| Smiles: | CCCC1=CC(=O)Oc2cc(c(cc12)[Cl])OCC(=O)OCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.9821 |
| logD: | 4.9821 |
| logSw: | -5.197 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.494 |
| InChI Key: | NIMLDIUAXFZTBP-UHFFFAOYSA-N |