RefChem:138099

2-cyanoethyl-[2-(docosanoylamino)ethyl]-ethyl-(2-hydroxyethyl)azanium;ethyl sulfate

Also Known As: N-Behenamidoethyl-N-cyanoethyl-N-ethyl-N-ethanol ammonium ethosulfate|Ethanaminium, N-(2-cyanoethyl)-N-ethyl-N-(2-hydroxyethyl)-2-((1-oxodocosyl)amino)-, ethyl sulfate (salt)|Ethanaminium, N-(2-cyanoethyl)-N-ethyl-N-(2-hydroxyethyl)-2-((1-oxodocosyl)amino)-, ethyl sulfate (1:1)|2-cyano-n-[2-(docosanoylamino)ethyl]-n-ethyl-n-(2-hydroxyethyl)ethanaminium ethyl sulfate|Ethanaminium, N-(2-cyanoethyl)-N-ethyl-N-(2-hydroxyethyl)-2-[(1-oxodocosyl)amino]-, ethyl sulfate (1:1)|Ethanaminium, N-(2-cyanoethyl)-N-ethyl-N-(2-hydroxyethyl)-2-[(1-oxodocosyl)amino]-, ethyl sulfate (salt)|2-Cyano-N-(2-docosanamidoethyl)-N-ethyl-N-(2-hydroxyethyl)ethan-1-aminium ethyl sulfate|2-cyanoethyl-[2-(docosanoylamino)ethyl]-ethyl-(2-hydroxyethyl)azanium; ethyl sulfate

Molecular Formula	C33H67N3O6S
Molecular Weight	633.47504 g/mol
LogP	7.15
Topological Polar Surface Area	139.55 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	7
Rotatable Bonds	30
Exact Mass	633.47504
Heavy Atoms	43
Complexity	760.2

Chemical Identifiers

CAS Number	67633-71-0
SMILES	CCCCCCCCCCCCCCCCCCCCCC(=O)NCC[N+](CC)(CCC#N)CCO.CCOS(=O)(=O)[O-]