Structure Info
- Chemspace ID
- CSMB00121441155 (Enamine MADE)
- IUPAC Name
- 2-bromo-2-(2,6-dimethylcyclohex-2-en-1-yl)acetonitrile
- Mol formula
- C10H14BrN
- Mol weight
- 228 Da
- Catalog Number(s)
- BBV-159143191, CSC121441155
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.05
- Heavy atoms count
- 12
- Rotatable bond count
- 1
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.7
- Polar surface area (Å)
- 24
- Hydrogen bond acceptors count
- 1
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00121441155
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