Isostearaminopropalkonium chloride structure

Isostearaminopropalkonium chloride

benzyl-dimethyl-[3-(16-methylheptadecanoylamino)propyl]azanium chloride

Also Known As: Isostearaminopropalkonium chloride|EINECS 266-777-5|ISOSTEARAMINOPROPALKONIUM CHLORIDE [INCI]|Benzyldimethyl(3-((1-oxoisooctadecyl)amino)propyl)ammonium chloride|N-(3-Isostearylamido)propyl-N,N-dimethyl-N-benzylammonium chloride|benzyl-dimethyl-[3-(16-methylheptadecanoylamino)propyl]azanium;chloride|Benzenemethanaminium, N,N-dimethyl-N-(3-((1-oxoisooctadecyl)amino)propyl)-, chloride|Benzenemethanaminium, N,N-dimethyl-N-(3-((1-oxoisooctadecyl)amino)propyl)-, chloride (1:1)|Benzenemethanaminium, N,N-dimethyl-N-[3-[(1-oxoisooctadecyl)amino]propyl]-, chloride|Benzyldimethyl[3-[(1-oxoisooctadecyl)amino]propyl]ammonium chloride|n-benzyl-n,n-dimethyl-3-[(16-methylheptadecanoyl)amino]propan-1-aminium chloride|benzyl-dimethyl-[3-(16-methylheptadecanoylamino)propyl]azanium chloride|benzyl-dimethyl-[3-(16-methylheptadecanoylamino)propyl]azanium, chloride|Benzyldimethyl[3- [(1- oxoisooctadecyl)amino]propyl]ammonium chloride|Benzenemethanaminium, N,N-dimethyl-N-[3-[(1-oxoisooctadecyl)amino]propyl]-, chloride (1:1)|N,N-Dimethyl-N-(3-((1-oxoisooctadecyl)amino)propyl)benzenemethana- minium chloride|N,N-Dimethyl-N-(3-((1-oxoisooctadecyl)amino)propyl)benzenemethana-minium chloride|266-777-5

CAS: 67633-59-4
Molecular Formula C30H55ClN2O
Molecular Weight 494.4003 g/mol
LogP 4.89
Topological Polar Surface Area 29.1 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
Rotatable Bonds 21
Exact Mass 494.4003
Heavy Atoms 34
Complexity 588.7

Chemical Identifiers

CAS Number 67633-59-4
SMILES CC(C)CCCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC1=CC=CC=C1.[Cl-]

Product Overview

Isostearaminopropalkonium chloride (CAS 67633-59-4), with molecular formula C30H55ClN2O and molecular weight 494.4003 g/mol. IUPAC: benzyl-dimethyl-[3-(16-methylheptadecanoylamino)propyl]azanium chloride.

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