6-chloro-7-hydroxy-3,4-dimethyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-chloro-7-hydroxy-3,4-dimethyl-2H-1-benzopyran-2-one
6-chloro-7-hydroxy-3,4-dimethyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D715-2426 |
| Compound Name: | 6-chloro-7-hydroxy-3,4-dimethyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 224.64 |
| Molecular Formula: | C11 H9 Cl O3 |
| Smiles: | CC1=C(C)c2cc(c(cc2OC1=O)O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.0831 |
| logD: | 2.7558 |
| logSw: | -3.1225 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.708 |
| InChI Key: | JMNRODDUVWGJDN-UHFFFAOYSA-N |