Basic information
- CAS
64049-56-5- Standard SMILES
CCCCCCCCCCCCCCCCCC[N+](C)(C)C.O=S(=O)([O-])c1ccc(F)cc1- InChIKey
LUFNUEUHZJKDIE-UHFFFAOYSA-M- Molecular formula
- C27H50FNO3S
- Average molar mass
- 487.8 g/mol
- Monoisotopic mass
- 487.34954379
Names & identifiers
- Preferred name
- Ammonium, octadecyltrimethyl-, p-fluorobenzenesulfonate
- IUPAC
- 4-fluorobenzenesulfonate;trimethyl(octadecyl)azanium
Names & synonyms
Octadecyltrimethylammonium p-fluorobenzenesulfonateAMMONIUM, OCTADECYLTRIMETHYL-, p-FLUOROBENZENESULFONATE64049-56-5DTXSID50214170RefChem:319434DTXCID50136661NSC85498NSC-85498N,N,N-Trimethyloctadecan-1-aminium 4-fluorobenzene-1-sulfonate1-Octadecanaminium,N,N-trimethyl-, salt with 4-fluorobenzenesulfonic acid (1:1)
Database identifiers
- CAS
64049-56-5- PubChem CID
- 46885
- DTXSID
DTXSID50214170
Properties
Computed structural properties
- Topological polar surface area
- 65.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 17
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 402
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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