3-(4-ethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl 2-methylpropanoate
Chemical Structure Depiction of
3-(4-ethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl 2-methylpropanoate
3-(4-ethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl 2-methylpropanoate
Compound characteristics
| Compound ID: | 4593-1369 |
| Compound Name: | 3-(4-ethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl 2-methylpropanoate |
| Molecular Weight: | 352.39 |
| Molecular Formula: | C21 H20 O5 |
| Smiles: | CCc1ccc(cc1)OC1=COc2cc(ccc2C1=O)OC(C(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7201 |
| logD: | 4.7201 |
| logSw: | -4.5495 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.219 |
| InChI Key: | YVLMKWKJGWFWJF-UHFFFAOYSA-N |