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87723-16-8

87723-16-8 | 1,5-Pentanediaminium, N,N'-didecyl-N,N,N',N'-tetramethyl-, dibromide

CAS No: 87723-16-8 Catalog No: AG004GGY MDL No:

Product Description

Catalog Number:
AG004GGY
Chemical Name:
1,5-Pentanediaminium, N,N'-didecyl-N,N,N',N'-tetramethyl-, dibromide
CAS Number:
87723-16-8
Molecular Formula:
C29H64Br2N2
Molecular Weight:
600.6399
IUPAC Name:
decyl-[5-[decyl(dimethyl)azaniumyl]pentyl]-dimethylazanium;dibromide
InChI:
InChI=1S/C29H64N2.2BrH/c1-7-9-11-13-15-17-19-22-26-30(3,4)28-24-21-25-29-31(5,6)27-23-20-18-16-14-12-10-8-2;;/h7-29H2,1-6H3;2*1H/q+2;;/p-2
InChI Key:
OPJXUWGAWCDVHV-UHFFFAOYSA-L
SMILES:
CCCCCCCCCC[N+](CCCCC[N+](CCCCCCCCCC)(C)C)(C)C.[Br-].[Br-]

Properties

Complexity:
328  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
600.342g/mol
Formal Charge:
0
Heavy Atom Count:
33  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
600.653g/mol
Monoisotopic Mass:
598.344g/mol
Rotatable Bond Count:
24  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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