5,5-dimethyl-2-(1,1,1-trichloro-4-oxopentan-3-yl)cyclohexane-1,3-dione
Chemical Structure Depiction of
5,5-dimethyl-2-(1,1,1-trichloro-4-oxopentan-3-yl)cyclohexane-1,3-dione
5,5-dimethyl-2-(1,1,1-trichloro-4-oxopentan-3-yl)cyclohexane-1,3-dione
Compound characteristics
| Compound ID: | 8009-6142 |
| Compound Name: | 5,5-dimethyl-2-(1,1,1-trichloro-4-oxopentan-3-yl)cyclohexane-1,3-dione |
| Molecular Weight: | 327.63 |
| Molecular Formula: | C13 H17 Cl3 O3 |
| Smiles: | CC(C(CC([Cl])([Cl])[Cl])C1C(CC(C)(C)CC1=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.606 |
| logD: | 1.1862 |
| logSw: | -2.8223 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.753 |
| InChI Key: | RIEWMHYKQFOXGC-MRVPVSSYSA-N |