2-[(2-chloroanilino)methylidene]-5,5-dimethylcyclohexane-1,3-dione
Chemical Structure Depiction of
2-[(2-chloroanilino)methylidene]-5,5-dimethylcyclohexane-1,3-dione
2-[(2-chloroanilino)methylidene]-5,5-dimethylcyclohexane-1,3-dione
Compound characteristics
| Compound ID: | K699-0082 |
| Compound Name: | 2-[(2-chloroanilino)methylidene]-5,5-dimethylcyclohexane-1,3-dione |
| Molecular Weight: | 277.75 |
| Molecular Formula: | C15 H16 Cl N O2 |
| Smiles: | CC1(C)CC(C(=CNc2ccccc2[Cl])C(C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.921 |
| logD: | 2.4867 |
| logSw: | -3.1994 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.558 |
| InChI Key: | RZJQWPKIVQACNN-UHFFFAOYSA-N |