2-[(4-chloroanilino)methylidene]-5,5-dimethylcyclohexane-1,3-dione
Chemical Structure Depiction of
2-[(4-chloroanilino)methylidene]-5,5-dimethylcyclohexane-1,3-dione
2-[(4-chloroanilino)methylidene]-5,5-dimethylcyclohexane-1,3-dione
Compound characteristics
| Compound ID: | 2104-0023 |
| Compound Name: | 2-[(4-chloroanilino)methylidene]-5,5-dimethylcyclohexane-1,3-dione |
| Molecular Weight: | 277.75 |
| Molecular Formula: | C15 H16 Cl N O2 |
| Smiles: | CC1(C)CC(C(=CNc2ccc(cc2)[Cl])C(C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1793 |
| logD: | 2.7985 |
| logSw: | -3.3688 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.256 |
| InChI Key: | BJLPOPUHHSFHDD-UHFFFAOYSA-N |