![1,1'-(Butane-1,4-diyl)bis[4-aza-1-azoniabicyclo[2.2.2]octane] Dibromide](https://resource.alfa-chemistry.com/structure/94630-50-9.gif)
Synonyms
B2754; SCHEMBL16968721; 1,1'-(Butane-1,4-diyl)bis[4-aza-1-azoniabicyclo[2.2.2]octane]dibromide; MFCD08276313; ANW-40303; 1,1'-(Butane-1,4-diyl)bis(1,4-diazabicyclo[2.2.2]octan-1-ium) dibromide; ACMC-209rsx;
IUPAC Name
1-[4-(4-aza-1-azoniabicyclo[2.2.2]octan-1-yl)butyl]-4-aza-1-azoniabicyclo[2.2.2]octane;dibromide;
Molecular Weight
440.268g/mol
Molecular Formula
C16H32Br2N4;
Canonical SMILES
C1C[N+]2(CCN1CC2)CCCC[N+]34CCN(CC3)CC4.[Br-].[Br-];
InChI
InChI=1S/C16H32N4.2BrH/c1(9-19-11-3-17(4-12-19)5-13-19)2-10-20-14-6-18(7-15-20)8-16-20;;/h1-16H2;2*1H/q+2;;/p-2;
InChI Key
HYFFXZLULREGEA-UHFFFAOYSA-L;
Complexity
279
Covalently-Bonded Unit Count
3
Exact Mass
440.097g/mol
H-Bond Acceptor
4
Heavy Atom Count
22
Monoisotopic Mass
438.099g/mol
Rotatable Bond Count
5
Topological Polar Surface Area
6.5A^2
