{7-[(3,5-dimethylphenyl)methoxy]-4-methyl-2-oxo-2H-1-benzopyran-3-yl}acetic acid
Chemical Structure Depiction of
{7-[(3,5-dimethylphenyl)methoxy]-4-methyl-2-oxo-2H-1-benzopyran-3-yl}acetic acid
{7-[(3,5-dimethylphenyl)methoxy]-4-methyl-2-oxo-2H-1-benzopyran-3-yl}acetic acid
Compound characteristics
| Compound ID: | D715-0320 |
| Compound Name: | {7-[(3,5-dimethylphenyl)methoxy]-4-methyl-2-oxo-2H-1-benzopyran-3-yl}acetic acid |
| Molecular Weight: | 352.39 |
| Molecular Formula: | C21 H20 O5 |
| Smiles: | CC1=C(CC(O)=O)C(=O)Oc2cc(ccc12)OCc1cc(C)cc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.3769 |
| logD: | 0.9182 |
| logSw: | -4.5886 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.771 |
| InChI Key: | JIFWKYFOJRYKLL-UHFFFAOYSA-N |