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Azocinium,1,1'-(1,5-pentanediyl)bis[octahydro-1-methyl-, dibromide (9CI) 5471-65-8 Azocinium,1,1'-(1,5-pentanediyl)bis[octahydro-1-methyl-, dibromide (9CI)(CAS No. 5471-65-8)
【Name】
Azocinium,1,1'-(1,5-pentanediyl)bis[octahydro-1-methyl-, dibromide (9CI)
【CAS Registry number】
5471-65-8
【Synonyms】
NSC 28409
【Molecular Formula】
C21H44 N2 . 2 Br (Products with the same molecular formula)
【Molecular Weight】
324.5864
【Inchi】
InChI=1/C21H44N2/c1-22(16-10-5-3-6-11-17-22)20-14-9-15-21-23(2)18-12-7-4-8-13-19-23/h3-21H2,1-2H3/q+2
【Canonical SMILES】
C[N+]1(CCCCCC1)CCCCC[N+]2(CCCCCC2)C.[Br-]
Chemical and Physical Properties
【Density】
g/cm3
【Boiling Point】
°Cat760mmHg
【Flash Point】
°C
【Computed Properties】
Molecular Weight:376.4383 [g/mol]
Molecular Formula:C19H40BrN2+
H-Bond Donor:0
H-Bond Acceptor:1
Rotatable Bond Count:6
Exact Mass:375.237487
MonoIsotopic Mass:375.237487
Topological Polar Surface Area:0
Heavy Atom Count:22
Formal Charge:1
Complexity:243
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:2
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