{4-methyl-5,7-bis[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-1-benzopyran-3-yl}acetic acid
Chemical Structure Depiction of
{4-methyl-5,7-bis[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-1-benzopyran-3-yl}acetic acid
{4-methyl-5,7-bis[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-1-benzopyran-3-yl}acetic acid
Compound characteristics
| Compound ID: | Y041-2010 |
| Compound Name: | {4-methyl-5,7-bis[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-1-benzopyran-3-yl}acetic acid |
| Molecular Weight: | 358.39 |
| Molecular Formula: | C20 H22 O6 |
| Smiles: | CC(=C)COc1cc(c2C(C)=C(CC(O)=O)C(=O)Oc2c1)OCC(C)=C |
| Stereo: | ACHIRAL |
| logP: | 3.7811 |
| logD: | 0.3224 |
| logSw: | -4.1682 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.629 |
| InChI Key: | XJQKFQIGUMLRFM-UHFFFAOYSA-N |