6-chloro-7-hydroxy-4-propyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-chloro-7-hydroxy-4-propyl-2H-1-benzopyran-2-one
6-chloro-7-hydroxy-4-propyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D715-0013 |
| Compound Name: | 6-chloro-7-hydroxy-4-propyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 238.67 |
| Molecular Formula: | C12 H11 Cl O3 |
| Smiles: | CCCC1=CC(=O)Oc2cc(c(cc12)[Cl])O |
| Stereo: | ACHIRAL |
| logP: | 3.4368 |
| logD: | 3.1094 |
| logSw: | -3.4415 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.194 |
| InChI Key: | IWVJNZCCZUEDEM-UHFFFAOYSA-N |