2-[(6-chloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoic acid
Chemical Structure Depiction of
2-[(6-chloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoic acid
2-[(6-chloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoic acid
Compound characteristics
| Compound ID: | Y040-6779 |
| Compound Name: | 2-[(6-chloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoic acid |
| Molecular Weight: | 282.68 |
| Molecular Formula: | C13 H11 Cl O5 |
| Smiles: | CC(C(O)=O)Oc1cc2c(cc1[Cl])C(C)=CC(=O)O2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8157 |
| logD: | -1.1836 |
| logSw: | -3.1803 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.93 |
| InChI Key: | UBJGTVXAFAIJDS-ZETCQYMHSA-N |