Basic information
- CAS
146824-27-3- Standard SMILES
Cl[C@@H]1CN2CCC1CC2- InChIKey
NOLVABYTFMDREN-SSDOTTSWSA-N- Molecular formula
- C7H12ClN
- Average molar mass
- 145.63 g/mol
- Monoisotopic mass
- 145.0658271
Names & identifiers
- Preferred name
- Nsy4VE6kwc
- IUPAC
- (3S)-3-chloro-1-azabicyclo[2.2.2]octane
Names & synonyms
NSY4VE6KWC(3S)-3-Chloro-1-azabicyclo[2.2.2]octane3-Chloroquinuclidine, (3S)-146824-27-33-Chloro-1-azabicyclo[2.2.2]octane, (3S)-1-Azabicyclo[2.2.2]octane, 3-chloro-, (3S)-1-Azabicyclo[2.2.2]octane, 3-chloro-, (S)-
Database identifiers
- CAS
146824-27-3- PubChem CID
- 40487535
- UNII
- NSY4VE6KWC
- Nikkaji
- J521.881K
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 107
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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