2,2'-Oxybis(N,N,N-trimethylpropan-1-aminium) diiodide

HCID 46891

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Basic information

CAS: 64049-59-8
Standard SMILES: CC(C[N+](C)(C)C)OC(C)C[N+](C)(C)C.[I-].[I-]
InChIKey: FOSXBINENBQXPD-UHFFFAOYSA-L
Molecular formula: C12H30I2N2O
Average molar mass: 472.19 g/mol
Monoisotopic mass: 472.04476

Names & identifiers

Preferred name: 2,2'-Oxybis(N,N,N-trimethylpropan-1-aminium) diiodide
IUPAC: trimethyl-[2-[1-(trimethylazaniumyl)propan-2-yloxy]propyl]azanium diiodide

Names & synonyms

64049-59-8DTXSID409823362,2'-Oxybis(N,N,N-trimethylpropan-1-aminium) diiodideRefChem:1058906DTXCID701409599AMMONIUM, OXYBIS(1,2-PROPYLENE)BIS(TRIMETHYL-, DIIODIDE

Database identifiers

CAS: 64049-59-8
PubChem CID: 46891
DTXSID: DTXSID40982336

Properties

Computed structural properties

Topological polar surface area: 9.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 6
Heavy atoms: 17
Formal charge: 0
Complexity: 159

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