5,5-dimethyl-2-{[(2-methylpropyl)amino]methylidene}cyclohexane-1,3-dione
Chemical Structure Depiction of
5,5-dimethyl-2-{[(2-methylpropyl)amino]methylidene}cyclohexane-1,3-dione
5,5-dimethyl-2-{[(2-methylpropyl)amino]methylidene}cyclohexane-1,3-dione
Compound characteristics
| Compound ID: | 2104-0002 |
| Compound Name: | 5,5-dimethyl-2-{[(2-methylpropyl)amino]methylidene}cyclohexane-1,3-dione |
| Molecular Weight: | 223.31 |
| Molecular Formula: | C13 H21 N O2 |
| Smiles: | CC(C)CNC=C1C(CC(C)(C)CC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5369 |
| logD: | 1.5361 |
| logSw: | -1.546 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.058 |
| InChI Key: | DMEABGIFGZRRBN-UHFFFAOYSA-N |