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D4422

Sigma-Aldrich

Docusate sodium salt

BioXtra, ≥99%

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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
Empirical Formula (Hill Notation):
C20H37NaO7S
CAS Number:
577-11-7
Molecular Weight:
444.56
Beilstein:
4117588
EC Number:
209-406-4
MDL number:
MFCD00012455
UNSPSC Code:
12161900
PubChem Substance ID:
57654103
NACRES:
NA.25

description

anionic

Quality Level

200

product line

BioXtra

Assay

≥99%

form

sheet

mol wt

444.56 g/mol

impurities

≤0.0005% Phosphorus (P)
≤0.1% Insoluble matter

solubility

passes test (per USP)

cation traces

Al: ≤0.001%
Ca: ≤0.001%
Cu: ≤0.0005%
Fe: ≤0.0005%
K: ≤0.01%
Mg: ≤0.0005%
Pb: ≤0.001%
Zn: ≤0.0005%

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 anionic surfactant.

Application

Docusate sodium salt has been used in a study to assess chromatography approaches for early screening of the phospholipidosis-inducing potential of pharmaceuticals. It has also been used in a study to investigate different formulations for drug delivery through the nail plate.
Forms reverse micelles in hydrocarbon solvents; Suitable for the solubilization of the major myelin transmembrane proteolipid

Pictograms

Corrosion
GHS05

Signal Word

Danger

Hazard Statements

H315,H318

Hazard Classifications

Eye Dam. 1 - Skin Irrit. 2

WGK

WGK 2

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

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Investigation of different formulations for drug delivery through the nail plate
Vejnovic, I., et al.
International Journal of Pharmaceutics, 386, 10-10 (2010)
Protein bioactivity and polymer orientation is affected by stabilizer incorporation for double-walled microspheres
Kokai, L., et al.
J. Controlled Release, 141, 9-9 (2010)
Zhengjin Jiang et al.
Journal of pharmaceutical and biomedical analysis, 61, 184-190 (2011-12-28)
Drug-induced phospholipidosis (PLD) is an excessive accumulation of polar phospholipids within cells as a result of medical treatment. Even though a direct link between in vitro drug-induced PLD and toxicity in humans has not yet been firmly established, the development
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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