AG00IMNM

18464-25-0 | 1,5-Pentanediaminium, N,N'-didodecyl-N,N,N',N'-tetramethyl-,dibromide

AG00IMNM

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CAS Number	18464-25-0
Catalog Number	AG00IMNM(AGN-PC-0QDGFK)
Chemical Name	1,5-Pentanediaminium, N,N'-didodecyl-N,N,N',N'-tetramethyl-,dibromide
IUPAC Name	dodecyl-[5-[dodecyl(dimethyl)azaniumyl]pentyl]-dimethylazanium;dibromide
InChI	InChI=1S/C33H72N2.2BrH/c1-7-9-11-13-15-17-19-21-23-26-30-34(3,4)32-28-25-29-33-35(5,6)31-27-24-22-20-18-16-14-12-10-8-2;;/h7-33H2,1-6H3;2*1H/q+2;;/p-2
InChI Key	WBKKEPDHDRCIOA-UHFFFAOYSA-L
MDL Number	MFCD28134479
Molecular Formula	C33H72Br2N2
Molecular Weight	656.7462
SMILES	C[N+](C)(CCCCCCCCCCCC)CCCCC[N+](C)(CCCCCCCCCCCC)C.[Br-].[Br-]
Synonyms	N1,N5-Didodecyl-N1,N1,N5,N5-tetramethylpentane-1,5-diaminium bromide, 18464-25-0, AK162074, CHEMBL3355740, AKOS024462590, DS-7444, 1,5-Pentanediaminium, N,N'-didodecyl-N,N,N',N'-tetramethyl-,dibromide,

Complexity	377
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	3
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	656.404g/mol
Formal Charge	0
Heavy Atom Count	37
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	656.761g/mol
Monoisotopic Mass	654.406g/mol
Rotatable Bond Count	28
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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