{6-chloro-4-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-1-benzopyran-3-yl}acetic acid
Chemical Structure Depiction of
{6-chloro-4-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-1-benzopyran-3-yl}acetic acid
{6-chloro-4-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-1-benzopyran-3-yl}acetic acid
Compound characteristics
| Compound ID: | D715-2574 |
| Compound Name: | {6-chloro-4-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-1-benzopyran-3-yl}acetic acid |
| Molecular Weight: | 322.74 |
| Molecular Formula: | C16 H15 Cl O5 |
| Smiles: | CC(=C)COc1cc2c(cc1[Cl])C(C)=C(CC(O)=O)C(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 3.7516 |
| logD: | 0.2929 |
| logSw: | -3.8026 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.13 |
| InChI Key: | LUKJSQGUBAGOAX-UHFFFAOYSA-N |