2-bromo-1-(3-methyladamantan-1-yl)ethan-1-one
Chemical Structure Depiction of
2-bromo-1-(3-methyladamantan-1-yl)ethan-1-one
2-bromo-1-(3-methyladamantan-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | 1438-0132 |
| Compound Name: | 2-bromo-1-(3-methyladamantan-1-yl)ethan-1-one |
| Molecular Weight: | 271.19 |
| Molecular Formula: | C13 H19 Br O |
| Smiles: | CC12CC3CC(C1)CC(C3)(C2)C(C[Br])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0476 |
| logD: | 4.0476 |
| logSw: | -4.1712 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 13.5187 |
| InChI Key: | LKQAVEHERLIMFA-UHFFFAOYSA-N |