(7,8-dihydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)acetic acid
Chemical Structure Depiction of
(7,8-dihydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)acetic acid
(7,8-dihydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)acetic acid
Compound characteristics
| Compound ID: | Y040-6769 |
| Compound Name: | (7,8-dihydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)acetic acid |
| Molecular Weight: | 250.2 |
| Molecular Formula: | C12 H10 O6 |
| Smiles: | CC1=C(CC(O)=O)C(=O)Oc2c1ccc(c2O)O |
| Stereo: | ACHIRAL |
| logP: | 1.1657 |
| logD: | -2.293 |
| logSw: | -2.1646 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 81.256 |
| InChI Key: | QCYGFCYJOHAJMS-UHFFFAOYSA-N |