1-Octyl-1-oxo-1lambda~5~-piperidine
Basic information
- CAS
74493-17-7- Standard SMILES
CCCCCCCC[N+]1([O-])CCCCC1- InChIKey
SHVWKKYCYUWFPD-UHFFFAOYSA-N- Molecular formula
- C13H27NO
- Average molar mass
- 213.36 g/mol
- Monoisotopic mass
- 213.20926449
Names & identifiers
- Preferred name
- 1-Octyl-1-oxo-1lambda~5~-piperidine
- IUPAC
- 1-octyl-1-oxidopiperidin-1-ium
Names & synonyms
74493-17-7NSC2918801-Octyl-1-oxo-1lambda~5~-piperidineDTXSID50315090NSC-291880
Database identifiers
- CAS
74493-17-7- PubChem CID
- 324903
- DTXSID
DTXSID50315090
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 18.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 7
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 153
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Compound notes
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