2-(2-chloro-9H-xanthen-9-yl)-1-(3-methoxyphenyl)butane-1,3-dione
Chemical Structure Depiction of
2-(2-chloro-9H-xanthen-9-yl)-1-(3-methoxyphenyl)butane-1,3-dione
2-(2-chloro-9H-xanthen-9-yl)-1-(3-methoxyphenyl)butane-1,3-dione
Compound characteristics
| Compound ID: | 7746-0013 |
| Compound Name: | 2-(2-chloro-9H-xanthen-9-yl)-1-(3-methoxyphenyl)butane-1,3-dione |
| Molecular Weight: | 406.86 |
| Molecular Formula: | C24 H19 Cl O4 |
| Smiles: | CC(C(C1c2ccccc2Oc2ccc(cc12)[Cl])C(c1cccc(c1)OC)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2931 |
| logD: | 5.2038 |
| logSw: | -5.9732 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.89 |
| InChI Key: | MGKOJWCFINKESS-UHFFFAOYSA-N |