3-(4-methoxyphenyl)-4-oxo-4H-1-benzopyran-7-yl 2,2-dimethylpropanoate
Chemical Structure Depiction of
3-(4-methoxyphenyl)-4-oxo-4H-1-benzopyran-7-yl 2,2-dimethylpropanoate
3-(4-methoxyphenyl)-4-oxo-4H-1-benzopyran-7-yl 2,2-dimethylpropanoate
Compound characteristics
| Compound ID: | Y041-2787 |
| Compound Name: | 3-(4-methoxyphenyl)-4-oxo-4H-1-benzopyran-7-yl 2,2-dimethylpropanoate |
| Molecular Weight: | 352.39 |
| Molecular Formula: | C21 H20 O5 |
| Smiles: | CC(C)(C)C(=O)Oc1ccc2C(C(=COc2c1)c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1014 |
| logD: | 4.1014 |
| logSw: | -4.4897 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.053 |
| InChI Key: | AJDUZBPZZMWNBB-UHFFFAOYSA-N |