Ammonium, (p-phenylenebis(oxy(2-hydroxytrimethylene)))bis(triethyl-, diiodide

HCID 58247

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Basic information

CAS: 101296-07-5
Standard SMILES: CC[N+](CC)(CC)CC(O)COc1ccc(OCC(O)C[N+](CC)(CC)CC)cc1.[I-].[I-]
InChIKey: ACXQJNKSRORXLX-UHFFFAOYSA-L
Molecular formula: C24H46I2N2O4
Average molar mass: 680.4 g/mol
Monoisotopic mass: 680.1547

Names & identifiers

Preferred name: Ammonium, (p-phenylenebis(oxy(2-hydroxytrimethylene)))bis(triethyl-, diiodide
IUPAC: triethyl-[2-hydroxy-3-[4-[2-hydroxy-3-(triethylazaniumyl)propoxy]phenoxy]propyl]azanium diiodide

Names & synonyms

AMMONIUM, (p-PHENYLENEBIS(OXY(2-HYDROXYTRIMETHYLENE)))BIS(TRIETHYL-, DIIODIDE101296-07-5(p-Phenylenebis(oxy(2-hydroxytrimethylene)))bis(triethylammonium iodide)RefChem:319086DTXSID509060433,3'-[1,4-Phenylenebis(oxy)]bis(N,N,N-triethyl-2-hydroxypropan-1-aminium) diiodide

Database identifiers

CAS: 101296-07-5
PubChem CID: 58247
DTXSID: DTXSID50906043

Properties

Computed structural properties

Topological polar surface area: 58.9 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 6
Rotatable bonds: 16
Heavy atoms: 32
Formal charge: 0
Complexity: 376

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