{4-methyl-2-oxo-7-[(propan-2-yl)oxy]-2H-1-benzopyran-3-yl}acetic acid
Chemical Structure Depiction of
{4-methyl-2-oxo-7-[(propan-2-yl)oxy]-2H-1-benzopyran-3-yl}acetic acid
{4-methyl-2-oxo-7-[(propan-2-yl)oxy]-2H-1-benzopyran-3-yl}acetic acid
Compound characteristics
| Compound ID: | D715-0329 |
| Compound Name: | {4-methyl-2-oxo-7-[(propan-2-yl)oxy]-2H-1-benzopyran-3-yl}acetic acid |
| Molecular Weight: | 276.29 |
| Molecular Formula: | C15 H16 O5 |
| Smiles: | CC(C)Oc1ccc2C(C)=C(CC(O)=O)C(=O)Oc2c1 |
| Stereo: | ACHIRAL |
| logP: | 2.2765 |
| logD: | -1.1822 |
| logSw: | -2.8899 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.347 |
| InChI Key: | XYXKCFPAXXNILU-UHFFFAOYSA-N |