methyl [(6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]acetate
Chemical Structure Depiction of
methyl [(6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]acetate
methyl [(6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]acetate
Compound characteristics
| Compound ID: | 3330-4246 |
| Compound Name: | methyl [(6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]acetate |
| Molecular Weight: | 344.75 |
| Molecular Formula: | C18 H13 Cl O5 |
| Smiles: | COC(COc1cc2c(cc1[Cl])C(=CC(=O)O2)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3286 |
| logD: | 3.3286 |
| logSw: | -3.7927 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.539 |
| InChI Key: | LLJWJMLMKXMMGS-UHFFFAOYSA-N |