Structure Info
- Chemspace ID
- CSCS20539820921 (Synthesis)
- IUPAC Name
- (1r,4r)-1-ethynyl-2-azabicyclo[2.1.1]hexane-4-carboxylic acid hydrochloride
- Mol formula
- C8H10ClNO2
- Mol weight
- 188 Da
- Catalog Number(s)
- EN300-52134937, ZX-NM320386
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -2.59
- Heavy atoms count
- 12
- Rotatable bond count
- 1
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.625
- Polar surface area (Å)
- 49
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSCS20539820921
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