methyl [(6-chloro-4-methyl-2-oxo-3-propyl-2H-1-benzopyran-7-yl)oxy]acetate
Chemical Structure Depiction of
methyl [(6-chloro-4-methyl-2-oxo-3-propyl-2H-1-benzopyran-7-yl)oxy]acetate
methyl [(6-chloro-4-methyl-2-oxo-3-propyl-2H-1-benzopyran-7-yl)oxy]acetate
Compound characteristics
| Compound ID: | Y040-0121 |
| Compound Name: | methyl [(6-chloro-4-methyl-2-oxo-3-propyl-2H-1-benzopyran-7-yl)oxy]acetate |
| Molecular Weight: | 324.76 |
| Molecular Formula: | C16 H17 Cl O5 |
| Smiles: | CCCC1=C(C)c2cc(c(cc2OC1=O)OCC(=O)OC)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.8311 |
| logD: | 3.8311 |
| logSw: | -4.2604 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.325 |
| InChI Key: | SWEFFABQYMNCMF-UHFFFAOYSA-N |