RefChem:77107 structure

RefChem:77107

3-[dimethyl-[3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctylsulfonylamino)propyl]azaniumyl]propanoate

Also Known As: EINECS 263-232-3|1-Propanaminium, N-(2-carboxyethyl)-N,N-dimethyl-3-[[(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)sulfonyl]amino]-, inner salt|1-Propanaminium, N-(2-carboxyethyl)-N,N-dimethyl-3-(((3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)sulfonyl)amino)-, inner salt|(2-carboxyethyl)dimethyl-3-[[(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)sulphonyl]amino]propylammonium hydroxide|3-[dimethyl(3-{[(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)sulfonyl]amino}propyl)ammonio]propanoate|N-(2-Carboxyethyl)-N,N-dimethyl-3-[[(perfluorohexyl)ethylsulfonyl]amino]propanaminium|(2-Carboxyethyl)dimethyl-3-(((3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)sulphonyl)amino)propylammonium hydroxide|(2-Carboxyethyl)dimethyl-3-[[(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)sulfonyl]amino]propylammonium hydroxide|1-Propanaminium, N-(2-carboxyethyl)-N,N-dimethyl-3-[[(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)sulfonyl]amino]-, hydroxide, inner salt|3-[dimethyl-[3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctylsulfonylamino)propyl]azaniumyl]propanoate|3-{Dimethyl[3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctane-1-sulfonamido)propyl]azaniumyl}propanoate|3-{dimethyl[3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctanesulfonamido)propyl]azaniumyl}propanoate|N-(2-Carboxylatoethyl)-N,N-dimethyl-3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctylsulfonylamino)-1-propanaminium

CAS: 61798-69-4
Molecular Formula C16H21F13N2O4S
Molecular Weight 584.10144 g/mol
LogP 2.64
Topological Polar Surface Area 86.3 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 4
Rotatable Bonds 15
Exact Mass 584.10144
Heavy Atoms 36
Complexity 873.8

Chemical Identifiers

CAS Number 61798-69-4
SMILES C[N+](C)(CCCNS(=O)(=O)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CCC(=O)[O-]

Product Overview

RefChem:77107 (CAS 61798-69-4), with molecular formula C16H21F13N2O4S and molecular weight 584.10144 g/mol. IUPAC: 3-[dimethyl-[3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctylsulfonylamino)propyl]azaniumyl]propanoate.

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