2-{[(butan-2-yl)amino]methylidene}-5,5-dimethylcyclohexane-1,3-dione
Chemical Structure Depiction of
2-{[(butan-2-yl)amino]methylidene}-5,5-dimethylcyclohexane-1,3-dione
2-{[(butan-2-yl)amino]methylidene}-5,5-dimethylcyclohexane-1,3-dione
Compound characteristics
| Compound ID: | 2567-0113 |
| Compound Name: | 2-{[(butan-2-yl)amino]methylidene}-5,5-dimethylcyclohexane-1,3-dione |
| Molecular Weight: | 223.31 |
| Molecular Formula: | C13 H21 N O2 |
| Smiles: | CCC(C)NC=C1C(CC(C)(C)CC1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9676 |
| logD: | 1.9655 |
| logSw: | -1.9773 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.291 |
| InChI Key: | ORRJDBSTNQQIAI-VIFPVBQESA-N |