Ammonium, ((2-(2-(ethyldimethylammonio)ethoxy)-2-methyl)ethyl)ethyldimethyl-, diiodide

HCID 46085

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Basic information

CAS: 63982-28-5
Standard SMILES: CC[N+](C)(C)CCOC(C)C[N+](C)(C)CC.[I-].[I-]
InChIKey: KWPUZGACLSKSKM-UHFFFAOYSA-L
Molecular formula: C13H32I2N2O
Average molar mass: 486.22 g/mol
Monoisotopic mass: 486.06041

Names & identifiers

Preferred name: Ammonium, ((2-(2-(ethyldimethylammonio)ethoxy)-2-methyl)ethyl)ethyldimethyl-, diiodide
IUPAC: ethyl-[2-[2-[ethyl(dimethyl)azaniumyl]ethoxy]propyl]-dimethylazanium diiodide

Names & synonyms

HL-870563982-28-5Ammonium, ((2-(2-(ethyldimethylammonio)ethoxy)-2-methyl)ethyl)ethyldimethyl-, diiodideAmmonium, (((2-(dimethylethylammonio)-1-methyl)ethoxy)ethyl)dimethylethyl-, diiodideRefChem:318613DTXSID10981679N-Ethyl-2-{2-[ethyl(dimethyl)azaniumyl]ethoxy}-N,N-dimethylpropan-1-aminium diiodideN-Ethyl-2-{2-[ethyldi(methyl)azaniumyl]ethoxy}-N,N-dimethylpropan-1-aminium diiodide

Database identifiers

CAS: 63982-28-5
PubChem CID: 46085
DTXSID: DTXSID10981679

Properties

Computed structural properties

Topological polar surface area: 9.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 8
Heavy atoms: 18
Formal charge: 0
Complexity: 190

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