CAS 25155-18-4 Methylbenzethonium chloride - Analytical Products / Alfa Chemistry

CAT	APS25155184
CAS	25155-18-4
Structure
Synonyms	Benzenemethanaminium, N,N-dimethyl-N-[2-[2-[methyl-4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy]ethyl]-, chloride (1:1), 2-(2-(p-(Diisobutyl)cresoxy)ethoxy)ethyldimethylbenzylammonium chloride, Benzyldimethyl[2-[2-[[4-(1,1,3,3-tetramethylbutyl)tolyl]oxy]ethoxy]ethyl]ammonium chloride (7CI), Benzenemethanaminium, N,N-dimethyl-N-[2-[2-[methyl-4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy]ethyl]-, chloride (9CI),Methylbenzethonium Chloride, Diaparene chloride, Hyamine 10X, Ammonium, benzyldimethyl[2-[2-[[4-(1,1,3,3-tetramethylbutyl)tolyl]oxy]ethoxy]ethyl]-, chloride (8CI), Methylbenzethonium chloride (6CI)
IUPAC Name	benzyl-dimethyl-[2-[2-[2-methyl-4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]ethyl]azanium;chloride
Molecular Weight	462.11
Molecular Formula	C28H44NO2.Cl
Canonical SMILES	[Cl-].Cc1cc(ccc1OCCOCC[N+](C)(C)Cc2ccccc2)C(C)(C)CC(C)(C)C
InChI	InChI=1S/C28H44NO2.ClH/c1-23-20-25(28(5,6)22-27(2,3)4)14-15-26(23)31-19-18-30-17-16-29(7,8)21-24-12-10-9-11-13-24;/h9-15,20H,16-19,21-22H2,1-8H3;1H/q+1;/p-1

Accurate Mass	461.3061
Format	Neat