ethyl {[4-methyl-3-(3-methylbutyl)-2-oxo-2H-1-benzopyran-7-yl]oxy}acetate
Chemical Structure Depiction of
ethyl {[4-methyl-3-(3-methylbutyl)-2-oxo-2H-1-benzopyran-7-yl]oxy}acetate
ethyl {[4-methyl-3-(3-methylbutyl)-2-oxo-2H-1-benzopyran-7-yl]oxy}acetate
Compound characteristics
| Compound ID: | 6486-0014 |
| Compound Name: | ethyl {[4-methyl-3-(3-methylbutyl)-2-oxo-2H-1-benzopyran-7-yl]oxy}acetate |
| Molecular Weight: | 332.4 |
| Molecular Formula: | C19 H24 O5 |
| Smiles: | CCOC(COc1ccc2C(C)=C(CCC(C)C)C(=O)Oc2c1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9871 |
| logD: | 3.9871 |
| logSw: | -4.2257 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.818 |
| InChI Key: | YFYRISCJLLUEGO-UHFFFAOYSA-N |