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86140

Sigma-Aldrich

Docusate sodium salt

purum, ≥96.0% (TLC)

Synonym(s):

AOT, Bis(2-ethylhexyl) sulfosuccinate sodium salt, Sodium bis(2-ethylhexyl) sulfosuccinate, Sulfobutanedioic acid bis(2-ethylhexyl ester) sodium salt, Sulfosuccinic acid bis(2-ethylhexyl) ester sodium salt, ‘Dioctyl’ sulfosuccinate sodium salt

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About This Item

Empirical Formula (Hill Notation):
C20H37NaO7S
CAS Number:
577-11-7
Molecular Weight:
444.56
Beilstein/REAXYS Number:
4117588
EC Number:
209-406-4
MDL number:
MFCD00012455
UNSPSC Code:
12352100
PubChem Substance ID:
329769440
NACRES:
NA.22

grade

purum

Quality Level

200

assay

≥96.0% (TLC)

form

solid

impurities

≤2% water

functional group

ester
sulfonic acid

SMILES string

[Na+].CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S([O-])(=O)=O

InChI

1S/C20H38O7S.Na/c1-5-9-11-16(7-3)14-26-19(21)13-18(28(23,24)25)20(22)27-15-17(8-4)12-10-6-2;/h16-18H,5-15H2,1-4H3,(H,23,24,25);/q;+1/p-1

InChI key

APSBXTVYXVQYAB-UHFFFAOYSA-M

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General description

Docusate sodium salt is an emollient which can combine with the active pharmaceutical ingredients (APIs) such as ranitidine hydrochloride and lidocaine hydrochloride to form hydrophobic ionic liquids (IL-APIs)).

Application

Docusate sodium salt can be used as a surfactant in the synthesis of magnetic nanoparticles by co-precipitation method.
Forms reverse micelles in hydrocarbon solvents; Suitable for the solubilization of the major myelin transmembrane proteolipid

pictograms

Corrosion
GHS05

signalword

Danger

hcodes

H315,H318

Hazard Classifications

Eye Dam. 1 - Skin Irrit. 2

Storage Class

11 - Combustible Solids

wgk_germany

WGK 2

ppe

dust mask type N95 (US), Eyeshields, Gloves

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Certificates of Analysis (COA)

Lot/Batch Number
BCCL2903
BCCK0933
BCCK4259
BCCH8018
BCCG6370

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The third evolution of ionic liquids: active pharmaceutical ingredients
Hough WL, et al.
New. J. Chem., 31(8), 1429-1436 (2007)
Development of multiple-layer polymeric particles for targeted and controlled drug delivery
Koppolu B, et al.
Nanomedicine: Nanotechnology, Biology, and Medicine, 6(2), 355-361 (2010)
In vitro evaluation of novel polymer-coated magnetic nanoparticles for controlled drug delivery
Rahimi M, et al.
Nanomedicine: Nanotechnology, Biology, and Medicine, 6(5), 672-680 (2010)
Giovanna Longhi et al.
Physical chemistry chemical physics : PCCP, 13(48), 21423-21431 (2011-11-04)
Positively charged supramolecular aggregates formed in vacuo by n AOTNa (sodium bis(2-ethylhexyl)sulfosuccinate) molecules and n(c) additional sodium ions, i.e. [AOT(n)Na(n+n(c))](n(c)), have been investigated by molecular dynamics (MD) simulations for n = 1-20 and n(c) = 0-5. Statistical analysis of physical
Gregory N Smith et al.
Langmuir : the ACS journal of surfaces and colloids, 29(10), 3252-3258 (2013-02-16)
The concentration-dependent aggregation of two surfactants, anionic sodium dioctylsulfosuccinate (Aerosol OT or AOT) and nonionic pentaethylene glycol monododecyl ether (C12E5), has been studied in cyclohexane-D12 using small-angle neutron scattering (SANS). A clear monomer-to-aggregate transition has been observed for both surfactants
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