Ammonium, (p-phenylenebis(carbonylmethyl))bis(dimethyl-2-hydroxyethyl-, dibromide

HCID 47253

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Basic information

CAS: 64059-47-8
Standard SMILES: C[N+](C)(CCO)CC(=O)c1ccc(C(=O)C[N+](C)(C)CCO)cc1.[Br-].[Br-]
InChIKey: PSPCIIILPMSIOJ-UHFFFAOYSA-L
Molecular formula: C18H30Br2N2O4
Average molar mass: 498.2 g/mol
Monoisotopic mass: 496.05723

Names & identifiers

Preferred name: Ammonium, (p-phenylenebis(carbonylmethyl))bis(dimethyl-2-hydroxyethyl-, dibromide
IUPAC: 2-hydroxyethyl-[2-[4-[2-[2-hydroxyethyl(dimethyl)azaniumyl]acetyl]phenyl]-2-oxoethyl]-dimethylazanium dibromide

Names & synonyms

Ammonium, (p-phenylenebis(carbonylmethyl))bis(dimethyl-2-hydroxyethyl-, dibromide64059-47-8(p-Phenylenebis(carbonylmethyl))bis(dimethyl-2-hydroxyethylammonium) dibromideRefChem:319085DTXSID40982553N,N'-[1,4-Phenylenebis(2-oxoethane-2,1-diyl)]bis(2-hydroxy-N,N-dimethylethan-1-aminium) dibromide

Database identifiers

CAS: 64059-47-8
PubChem CID: 47253
DTXSID: DTXSID40982553

Properties

Computed structural properties

Topological polar surface area: 74.6 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 6
Rotatable bonds: 10
Heavy atoms: 26
Formal charge: 0
Complexity: 387

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