5-({[3-(carboxymethyl)-4-methyl-2-oxo-2H-1-benzopyran-7-yl]oxy}methyl)furan-2-carboxylic acid
Chemical Structure Depiction of
5-({[3-(carboxymethyl)-4-methyl-2-oxo-2H-1-benzopyran-7-yl]oxy}methyl)furan-2-carboxylic acid
5-({[3-(carboxymethyl)-4-methyl-2-oxo-2H-1-benzopyran-7-yl]oxy}methyl)furan-2-carboxylic acid
Compound characteristics
| Compound ID: | Y040-9027 |
| Compound Name: | 5-({[3-(carboxymethyl)-4-methyl-2-oxo-2H-1-benzopyran-7-yl]oxy}methyl)furan-2-carboxylic acid |
| Molecular Weight: | 358.3 |
| Molecular Formula: | C18 H14 O8 |
| Smiles: | CC1=C(CC(O)=O)C(=O)Oc2cc(ccc12)OCc1ccc(C(O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 1.7357 |
| logD: | -2.2482 |
| logSw: | -2.3866 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.021 |
| InChI Key: | VGKXMWNZEVDSQM-UHFFFAOYSA-N |