Ammonium, dimethylethyl(2-(2-furfuryl)butyl)-, iodide

HCID 212957

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Basic information

CAS: 25433-51-6
Standard SMILES: CCC(Cc1ccco1)C[N+](C)(C)CC.[I-]
InChIKey: UTQRMZXOMNYKTH-UHFFFAOYSA-M
Molecular formula: C13H24INO
Average molar mass: 337.24 g/mol
Monoisotopic mass: 337.09026

Names & identifiers

Preferred name: Ammonium, dimethylethyl(2-(2-furfuryl)butyl)-, iodide
IUPAC: ethyl-[2-(furan-2-ylmethyl)butyl]-dimethylazanium iodide

Names & synonyms

Dimethylethyl(2-(2-furfuryl)butyl)ammonium iodideAmmonium, dimethylethyl(2-(2-furfuryl)butyl)-, iodide25433-51-6RefChem:319336DTXSID40948295N-Ethyl-2-[(furan-2-yl)methyl]-N,N-dimethylbutan-1-aminium iodide

Database identifiers

CAS: 25433-51-6
PubChem CID: 212957
DTXSID: DTXSID40948295

Properties

Computed structural properties

Topological polar surface area: 13.1 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 6
Heavy atoms: 16
Formal charge: 0
Complexity: 179

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