3-(6-chloro-2H,4H-1,3-benzodioxin-8-yl)-1-(2-hydroxy-4-methylphenyl)prop-2-en-1-one
Chemical Structure Depiction of
3-(6-chloro-2H,4H-1,3-benzodioxin-8-yl)-1-(2-hydroxy-4-methylphenyl)prop-2-en-1-one
3-(6-chloro-2H,4H-1,3-benzodioxin-8-yl)-1-(2-hydroxy-4-methylphenyl)prop-2-en-1-one
Compound characteristics
| Compound ID: | 2188-2747 |
| Compound Name: | 3-(6-chloro-2H,4H-1,3-benzodioxin-8-yl)-1-(2-hydroxy-4-methylphenyl)prop-2-en-1-one |
| Molecular Weight: | 330.77 |
| Molecular Formula: | C18 H15 Cl O4 |
| Smiles: | Cc1ccc(C(/C=C/c2cc(cc3COCOc23)[Cl])=O)c(c1)O |
| Stereo: | ACHIRAL |
| logP: | 4.5421 |
| logD: | 4.5212 |
| logSw: | -4.401 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.651 |
| InChI Key: | TVHJNPLUVOGNAC-UHFFFAOYSA-N |