Basic information
- CAS
75567-22-5- Standard SMILES
CCCCCCCCCCCCCCCCCC[N+]1([O-])CCCC1- InChIKey
XFQBGPSSXIBFJW-UHFFFAOYSA-N- Molecular formula
- C22H45NO
- Average molar mass
- 339.6 g/mol
- Monoisotopic mass
- 339.35011506
Names & identifiers
- Preferred name
- 1-Octadecyl-1-oxo-1lambda~5~-pyrrolidine
- IUPAC
- 1-octadecyl-1-oxidopyrrolidin-1-ium
Names & synonyms
75567-22-5NSC2918791-Octadecyl-1-oxo-1lambda~5~-pyrrolidineDTXSID40315089NSC-291879
Database identifiers
- CAS
75567-22-5- PubChem CID
- 324902
- DTXSID
DTXSID40315089
Properties
Computed structural properties
- XLogP
- 9
- Topological polar surface area
- 18.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 17
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 261
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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