RefChem:435944 structure

RefChem:435944

2-[2-hydroxyethyl(2-hydroxypropyl)amino]ethyl-methyl-bis(2-octadecanoyloxypropyl)azanium;methyl sulfate

Also Known As: EINECS 265-336-4|1-Propanaminium, 2-hydroxy-N-(2-((2-hydroxyethyl)(2-hydroxypropyl)amino)ethyl)-N-(2-hydroxypropyl)-N-methyl-, dioctadecanoate (ester), methyl sulfate (salt)|1-Propanaminium, 2-hydroxy-N-(2-((2-hydroxyethyl)(2-hydroxypropyl)amino)ethyl)-N-(2-hydroxypropyl)-N-methyl-, dioctadecanoate (ester), methyl sulfate (1:1)|n-{2-[(2-hydroxyethyl)(2-hydroxypropyl)amino]ethyl}-n-methyl-2-(octadecanoyloxy)-n-[2-(octadecanoyloxy)propyl]propan-1-aminium methyl sulfate|1-Propanaminium, 2-hydroxy-N-[2-[(2-hydroxyethyl)(2-hydroxypropyl)amino]ethyl]-N-(2-hydroxypropyl)-N-methyl-, dioctadecanoate (ester), methyl sulfate (salt)|(2-((2-Hydroxyethyl)(2-hydroxypropyl)amino)ethyl)bis(2-hydroxypropyl)(methyl)ammonium methyl sulphate, distearate (ester)|1-Propanaminium, 2-hydroxy-N-[2-[(2-hydroxyethyl)(2-hydroxypropyl)amino]ethyl]-N-(2-hydroxypropyl)-N-methyl-, dioctadecanoate (ester), methyl sulfate (1:1)|2-[2-hydroxyethyl(2-hydroxypropyl)amino]ethyl-methyl-bis(2-octadecanoyloxypropyl)azanium; methyl sulfate

CAS: 65059-55-4
Molecular Formula C51H104N2O10S
Molecular Weight 936.74115 g/mol
LogP 11.59
Topological Polar Surface Area 162.73 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 11
Rotatable Bonds 46
Exact Mass 936.74115
Heavy Atoms 64
Complexity 1086.6

Chemical Identifiers

CAS Number 65059-55-4
SMILES CCCCCCCCCCCCCCCCCC(=O)OC(C)C[N+](C)(CCN(CCO)CC(C)O)CC(C)OC(=O)CCCCCCCCCCCCCCCCC.COS(=O)(=O)[O-]

Product Overview

RefChem:435944 (CAS 65059-55-4), with molecular formula C51H104N2O10S and molecular weight 936.74115 g/mol. IUPAC: 2-[2-hydroxyethyl(2-hydroxypropyl)amino]ethyl-methyl-bis(2-octadecanoyloxypropyl)azanium;methyl sulfate.

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