3-Methoxy-N,N,N,4,5-pentamethylanilinium iodide

HCID 45800

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 63977-54-8
Standard SMILES: COc1cc([N+](C)(C)C)cc(C)c1C.[I-]
InChIKey: XXBSNFDFXXRLKZ-UHFFFAOYSA-M
Molecular formula: C12H20INO
Average molar mass: 321.2 g/mol
Monoisotopic mass: 321.05896

Names & identifiers

Preferred name: 3-Methoxy-N,N,N,4,5-pentamethylanilinium iodide
IUPAC: (3-methoxy-4,5-dimethylphenyl)-trimethylazanium iodide

Names & synonyms

63977-54-8DTXSID309814193-methoxy-N,N,N,4,5-pentamethylanilinium iodideRefChem:1068134DTXCID201408691(3,4-Dimethyl-5-methoxyphenyl)trimethylammonium iodideRo 2-3512AMMONIUM, (3,4-DIMETHYL-5-METHOXYPHENYL)TRIMETHYL-, IODIDE

Database identifiers

CAS: 63977-54-8
PubChem CID: 45800
DTXSID: DTXSID30981419

Properties

Computed structural properties

Topological polar surface area: 9.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 2
Heavy atoms: 15
Formal charge: 0
Complexity: 185

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…