3,6-dichloro-7-hydroxy-4-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3,6-dichloro-7-hydroxy-4-methyl-2H-1-benzopyran-2-one
3,6-dichloro-7-hydroxy-4-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-7126 |
| Compound Name: | 3,6-dichloro-7-hydroxy-4-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 245.06 |
| Molecular Formula: | C10 H6 Cl2 O3 |
| Smiles: | CC1=C(C(=O)Oc2cc(c(cc12)[Cl])O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.2353 |
| logD: | 2.9079 |
| logSw: | -3.1932 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.708 |
| InChI Key: | WQILGAJTSFVYMF-UHFFFAOYSA-N |