3-(3,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl acetate
Chemical Structure Depiction of
3-(3,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl acetate
3-(3,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl acetate
Compound characteristics
| Compound ID: | 3643-2380 |
| Compound Name: | 3-(3,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl acetate |
| Molecular Weight: | 324.33 |
| Molecular Formula: | C19 H16 O5 |
| Smiles: | CC(=O)Oc1ccc2C(C(=COc2c1)Oc1cc(C)cc(C)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.381 |
| logD: | 3.381 |
| logSw: | -3.7479 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.321 |
| InChI Key: | NIQRSRWDVOFZLJ-UHFFFAOYSA-N |