Home Other Building Blocks Hexafluronium Bromide

Hexafluronium Bromide

CAS No.:
317-52-2
Catalog Number:
AG00397Z
Molecular Formula:
C36H42Br2N2
Molecular Weight:
662.5401
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Product Description
Catalog Number:
AG00397Z
Chemical Name:
Hexafluronium Bromide
CAS Number:
317-52-2
Molecular Formula:
C36H42Br2N2
Molecular Weight:
662.5401
MDL Number:
MFCD00867695
IUPAC Name:
9H-fluoren-9-yl-[6-[9H-fluoren-9-yl(dimethyl)azaniumyl]hexyl]-dimethylazanium;dibromide
InChI:
InChI=1S/C36H42N2.2BrH/c1-37(2,35-31-21-11-7-17-27(31)28-18-8-12-22-32(28)35)25-15-5-6-16-26-38(3,4)36-33-23-13-9-19-29(33)30-20-10-14-24-34(30)36;;/h7-14,17-24,35-36H,5-6,15-16,25-26H2,1-4H3;2*1H/q+2;;/p-2
InChI Key:
WDEFPRUEZRUYNW-UHFFFAOYSA-L
SMILES:
C[N+](C1c2ccccc2c2c1cccc2)(CCCCCC[N+](C1c2ccccc2c2c1cccc2)(C)C)C.[Br-].[Br-]
EC Number:
206-265-0
UNII:
B64NJG83K2
Properties
Complexity:
663  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
662.169g/mol
Formal Charge:
0
Heavy Atom Count:
40  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
662.554g/mol
Monoisotopic Mass:
660.171g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties