Ammonium, (p-benzoquinon-2,5-ylenebis(iminotrimethylene))bis(diethylmethyl-, dibromide

HCID 16745

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Basic information

CAS: 2258-02-8
Standard SMILES: CC[N+](C)(CC)CCCNC1=CC(=O)C(NCCC[N+](C)(CC)CC)=CC1=O.[Br-].[Br-]
InChIKey: JDXMEIZJSUCGOZ-UHFFFAOYSA-N
Molecular formula: C22H42Br2N4O2
Average molar mass: 554.4 g/mol
Monoisotopic mass: 552.16745

Names & identifiers

Preferred name: Ammonium, (p-benzoquinon-2,5-ylenebis(iminotrimethylene))bis(diethylmethyl-, dibromide
IUPAC: 3-[[4-[3-[diethyl(methyl)azaniumyl]propylamino]-3,6-dioxocyclohexa-1,4-dien-1-yl]amino]propyl-diethyl-methylazanium dibromide

Names & synonyms

Ammonium, (p-benzoquinon-2,5-ylenebis(iminotrimethylene))bis(diethylmethyl-, dibromide2258-02-8RefChem:1076818NIOSH/BS4160000BS41600000(p-Quinon-2,5-ylenebis(iminotrimethylene))bis(diethylmethylammonium bromide)Ammonium, (p-quinon-2,5-ylenebis(iminotrimethylene))bis(diethylmethyl-, dibromideBenzoquinone, 2,5-bis(diethylaminopropylamino), bis-methobromide

Database identifiers

CAS: 2258-02-8
PubChem CID: 16745

Properties

Computed structural properties

Topological polar surface area: 58.2 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 6
Rotatable bonds: 14
Heavy atoms: 30
Formal charge: 0
Complexity: 535

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