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Basic information
- CAS
96943-88-3- Standard SMILES
ClC1CC2CCN1CC2- InChIKey
BZYQYFBFBXSMHK-UHFFFAOYSA-N- Molecular formula
- C7H12ClN
- Average molar mass
- 145.63 g/mol
- Monoisotopic mass
- 145.0658271
Names & identifiers
- Preferred name
- 1-Azabicyclo(2.2.2)-octane, 2-chloro-
- IUPAC
- 2-chloro-1-azabicyclo[2.2.2]octane
Names & synonyms
1-azabicyclo(2.2.2)-octane, 2-chloro-chloroquinuclidinequinuclidine chloride96943-88-31-azabicyclo[2.2.2]-octane, 2-chloroSCHEMBL7042524BZYQYFBFBXSMHK-UHFFFAOYSA-N
Database identifiers
- CAS
96943-88-3- PubChem CID
- 145299
Properties
Computed structural propertiesFilling in
- XLogP
- 1.9
- 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
2 records
Compound notes
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