[(2,2-dimethyl-4-oxo-3,4-dihydro-2H-1-benzopyran-7-yl)oxy]acetic acid
Chemical Structure Depiction of
[(2,2-dimethyl-4-oxo-3,4-dihydro-2H-1-benzopyran-7-yl)oxy]acetic acid
[(2,2-dimethyl-4-oxo-3,4-dihydro-2H-1-benzopyran-7-yl)oxy]acetic acid
Compound characteristics
| Compound ID: | Y040-6422 |
| Compound Name: | [(2,2-dimethyl-4-oxo-3,4-dihydro-2H-1-benzopyran-7-yl)oxy]acetic acid |
| Molecular Weight: | 250.25 |
| Molecular Formula: | C13 H14 O5 |
| Smiles: | CC1(C)CC(c2ccc(cc2O1)OCC(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6868 |
| logD: | -2.5502 |
| logSw: | -2.3828 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.702 |
| InChI Key: | JOJCMTSSOUZRSI-UHFFFAOYSA-N |