2-(2-chloro-9H-xanthen-9-yl)-1-(4-methylphenyl)butane-1,3-dione
Chemical Structure Depiction of
2-(2-chloro-9H-xanthen-9-yl)-1-(4-methylphenyl)butane-1,3-dione
2-(2-chloro-9H-xanthen-9-yl)-1-(4-methylphenyl)butane-1,3-dione
Compound characteristics
| Compound ID: | 7746-0008 |
| Compound Name: | 2-(2-chloro-9H-xanthen-9-yl)-1-(4-methylphenyl)butane-1,3-dione |
| Molecular Weight: | 390.87 |
| Molecular Formula: | C24 H19 Cl O3 |
| Smiles: | CC(C(C1c2ccccc2Oc2ccc(cc12)[Cl])C(c1ccc(C)cc1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.5803 |
| logD: | 5.491 |
| logSw: | -6.0449 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.346 |
| InChI Key: | WJRIFCQAHGRTBD-UHFFFAOYSA-N |