3-(adamantan-1-yl)-1,1,1-trifluoro-5,5-dimethylhexane-2,4-dione
Chemical Structure Depiction of
3-(adamantan-1-yl)-1,1,1-trifluoro-5,5-dimethylhexane-2,4-dione
3-(adamantan-1-yl)-1,1,1-trifluoro-5,5-dimethylhexane-2,4-dione
Compound characteristics
| Compound ID: | 8017-0229 |
| Compound Name: | 3-(adamantan-1-yl)-1,1,1-trifluoro-5,5-dimethylhexane-2,4-dione |
| Molecular Weight: | 330.39 |
| Molecular Formula: | C18 H25 F3 O2 |
| Smiles: | CC(C)(C)C(C(C(C(F)(F)F)=O)C12CC3CC(CC(C3)C2)C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8236 |
| logD: | 4.8236 |
| logSw: | -4.5214 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.749 |
| InChI Key: | WSASGHMQGPVLPU-RQYMUSGFSA-N |