Basic information
- CAS
21982-87-6- Standard SMILES
C[N+](C)(C)CCOc1ccccc1.[I-]- InChIKey
JKSPKYSHISSXGR-UHFFFAOYSA-M- Molecular formula
- C11H18INO
- Average molar mass
- 307.17 g/mol
- Monoisotopic mass
- 307.04331
Names & identifiers
- Preferred name
- Ammonium, (2-phenoxyethyl)trimethyl-, iodide
- IUPAC
- trimethyl(2-phenoxyethyl)azanium iodide
- English name
- trimethyl-(2-phenoxyethyl)azanium
- Molecular formula
- C11H18NO+
- Molecular weight
- 0
Names & synonyms
AMMONIUM, (2-PHENOXYETHYL)TRIMETHYL-, IODIDERefChem:1076739Choline phenyl ether iodide21982-87-6NSC9550Phenyl ether choline iodide2-Phenoxy-N,N,N-trimethylethanaminium iodidetrimethyl(2-phenoxyethyl)azanium;iodide(2-Phenoxyethyl)trimethylammonium iodideIodure de phenoxyethyl-trimethylammonium [French]Ethanaminium, 2-phenoxy-N,N,N-trimethyl-, iodideDTXSID40944575
Show more names
trimethyl-(2-phenoxyethyl)azaniumNSC 9550NSC-9550Iodure de phenoxyethyl-trimethylammoniumN,N,N-Trimethyl-2-phenoxyethan-1-aminium iodide
Database identifiers
- CAS
21982-87-6- PubChem CID
- 30890
- DTXSID
DTXSID40944575
Properties
Computed structural properties
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 134
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…