Basic information
- Standard SMILES
C=C1C(=O)C2CCN1CC2.Cl- InChIKey
AGFGFBLVWBFYCR-UHFFFAOYSA-N- Molecular formula
- C8H12ClNO
- Average molar mass
- 173.64 g/mol
- Monoisotopic mass
- 173.0607417
Names & identifiers
- Preferred name
- 1-Azabicyclo(2.2.2)octan-3-one, 2-methylene-, hydrochloride (1:1)
- IUPAC
- 2-methylidene-1-azabicyclo[2.2.2]octan-3-one;hydrochloride
Names & synonyms
5832-54-21-Azabicyclo(2.2.2)octan-3-one, 2-methylene-, hydrochloride (1:1)1-Azabicyclo[2.2.2]octan-3-one, 2-methylene-, hydrochloride (1:1)RefChem:2276132-methylene-3-quinuclidinone hydrochlorideUQX4TGR7ZRSCHEMBL2229287DTXSID70973858NSC93806NSC-93806AKOS0062810142-methylene-3-oxoquinuclidine hydrochloride
Show more names
NS000476523-Quinuclidinone, 2-methylene-, hydrochloride1-Azabicyclo[2.2.2]octan-3-one, 2-methylene-,hydrochloride (1:1)2-Methylidene-1-azabicyclo[2.2.2]octan-3-one--hydrogen chloride (1/1)
Database identifiers
- CAS
5832-54-2- PubChem CID
- 18401284
- DTXSID
DTXSID70973858- UNII
- UQX4TGR7ZR
- EC Number
- 227-413-0
Properties
Computed structural properties
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 189
Related reactions
3 records
Linked notes
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