2-(6-chloro-7-methyl-4-oxo-4H-1-benzopyran-2-yl)benzoic acid
Chemical Structure Depiction of
2-(6-chloro-7-methyl-4-oxo-4H-1-benzopyran-2-yl)benzoic acid
2-(6-chloro-7-methyl-4-oxo-4H-1-benzopyran-2-yl)benzoic acid
Compound characteristics
Compound ID: | 8268-10698 |
Compound Name: | 2-(6-chloro-7-methyl-4-oxo-4H-1-benzopyran-2-yl)benzoic acid |
Molecular Weight: | 314.72 |
Molecular Formula: | C17 H11 Cl O4 |
Smiles: | Cc1cc2c(cc1[Cl])C(C=C(c1ccccc1C(O)=O)O2)=O |
Stereo: | ACHIRAL |
logP: | 4.7706 |
logD: | 1.1181 |
logSw: | -4.6659 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 50.193 |
InChI Key: | GVXYBGSYNGEFQF-UHFFFAOYSA-N |