methyl {4,7-dimethyl-5-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-1-benzopyran-3-yl}acetate
Chemical Structure Depiction of
methyl {4,7-dimethyl-5-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-1-benzopyran-3-yl}acetate
methyl {4,7-dimethyl-5-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-1-benzopyran-3-yl}acetate
Compound characteristics
| Compound ID: | Y040-0224 |
| Compound Name: | methyl {4,7-dimethyl-5-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-1-benzopyran-3-yl}acetate |
| Molecular Weight: | 316.35 |
| Molecular Formula: | C18 H20 O5 |
| Smiles: | CC(=C)COc1cc(C)cc2c1C(C)=C(CC(=O)OC)C(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 3.8657 |
| logD: | 3.8657 |
| logSw: | -4.2837 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.325 |
| InChI Key: | WSWKEIDKSYPCCS-UHFFFAOYSA-N |