7-chloro-4-methyl-6-(2-oxopropoxy)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-chloro-4-methyl-6-(2-oxopropoxy)-2H-1-benzopyran-2-one
7-chloro-4-methyl-6-(2-oxopropoxy)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 8012-1957 |
| Compound Name: | 7-chloro-4-methyl-6-(2-oxopropoxy)-2H-1-benzopyran-2-one |
| Molecular Weight: | 266.68 |
| Molecular Formula: | C13 H11 Cl O4 |
| Smiles: | CC1=CC(=O)Oc2cc(c(cc12)OCC(C)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.2768 |
| logD: | 2.2768 |
| logSw: | -3.1079 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.567 |
| InChI Key: | UOPFJEQRIVWCTP-UHFFFAOYSA-N |