Aerosol OT(AOT) - Moligand™, ≥96% , CAS No.577-11-7

CAS: 577-11-7 Cat. No.: A106730 Molecular Weight: 444.56 Beilstein Registry Number: 4117588 EC Number: 209-406-4
AVAILABLE TO ORDER
GRADE & PURITY Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥96%
Synonyms
Diotilan | Dioctyl sulfosuccinate sodium salt | Dioctylal | Constonate | Molatoc | Molcer | Doxol | Bis(2-ethylhexyl) sulfosuccinate sodium salt | Docusate (Sodium) | Nevax | Soliwax | Dialose | Waxsol | Adekacol EC 8600 | Dioctyl sodium sulfosuccinate |
Storage
Argon charged,Room temperature
Shipped In
Normal
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Size
Status
Price
Qty
25g
A106730-25g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

$9.90

$13.90
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100g
A106730-100g
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$27.90
500g
A106730-500g
2

$37.90

$55.90
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Why this grade

Moligand™, ≥96% Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Argon charged,Room temperature Ships Normal Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 57 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Overview

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.

Specifications

Synonyms
Diotilan | Dioctyl sulfosuccinate sodium salt | Dioctylal | Constonate | Molatoc | Molcer | Doxol | Bis(2-ethylhexyl) sulfosuccinate sodium salt | Docusate (Sodium) | Nevax | Soliwax | Dialose | Waxsol | Adekacol EC 8600 | Dioctyl sodium sulfosuccinate |
Specifications & Purity
Moligand™, ≥96%
Storage
Argon charged, Room temperature
Shipped In
Normal
Grade
Moligand™
Purity
≥96%
Names and Identifiers
Canonical SmilesCCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)[O-].[Na+]
IUPAC Namesodium;1,4-bis(2-ethylhexoxy)-1,4-dioxobutane-2-sulfonate
InChIKeyAPSBXTVYXVQYAB-UHFFFAOYSA-M
INCHI1S/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
Isomeric SMILES CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)[O-].[Na+]
WGK Germany 3
RTECS WN0525000
Molecular Weight 444.56
Beilstein 4117588
Reaxy-Rn 4117588
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4117588&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassLipids and lipid-like molecules
ClassFatty Acyls
SubclassFatty acid esters
Intermediate Tree Nodes Not available
Direct ParentFatty acid esters
Alternative Parents Dicarboxylic acids and derivatives  Sulfonyls  Organosulfonic acids  Alkanesulfonic acids  Carboxylic acid esters  Organic sodium salts  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAliphatic acyclic compounds
Substituents Fatty acid ester - Dicarboxylic acid or derivatives - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Alkanesulfonic acid - Carboxylic acid ester - Carboxylic acid derivative - Organic alkali metal salt - Carbonyl group - Organosulfur compound - Organooxygen compound - Organic oxide - Organic oxygen compound - Organic salt - Organic sodium salt - Hydrocarbon derivative - Aliphatic acyclic compound
DescriptionThis compound belongs to the class of organic compounds known as fatty acid esters. These are carboxylic ester derivatives of a fatty acid.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
VDR Tclin Vitamin D receptor (26531 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
PPARG Tclin Peroxisome proliferator-activated receptor gamma (15191 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
PPARA Tclin Peroxisome proliferator-activated receptor alpha (9197 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
RXRA Tclin Retinoid X receptor alpha (3637 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (345557 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

48 results found

Lot NumberCertificate TypeDateItem
F2604276Certificate of AnalysisMay 27, 2026 A106730
F2604236Certificate of AnalysisMay 27, 2026 A106730
F2604235Certificate of AnalysisMay 27, 2026 A106730
A2605429Certificate of AnalysisDec 30, 2025 A106730
A2605433Certificate of AnalysisDec 30, 2025 A106730
A2605432Certificate of AnalysisDec 30, 2025 A106730
A2605430Certificate of AnalysisDec 30, 2025 A106730
A2605431Certificate of AnalysisDec 30, 2025 A106730
I2524099Certificate of AnalysisSep 01, 2025 A106730
I2524158Certificate of AnalysisSep 01, 2025 A106730
I2524159Certificate of AnalysisSep 01, 2025 A106730
I2524160Certificate of AnalysisSep 01, 2025 A106730
E2506017Certificate of AnalysisMar 14, 2025 A106730
E2506007Certificate of AnalysisMar 14, 2025 A106730
E2506006Certificate of AnalysisMar 14, 2025 A106730
E2506005Certificate of AnalysisMar 14, 2025 A106730
B2506280Certificate of AnalysisJan 04, 2025 A106730
B2506270Certificate of AnalysisJan 04, 2025 A106730
B2506271Certificate of AnalysisJan 04, 2025 A106730
B2506273Certificate of AnalysisJan 04, 2025 A106730
J2410421Certificate of AnalysisSep 20, 2024 A106730
G2525040Certificate of AnalysisSep 20, 2024 A106730
J2410418Certificate of AnalysisSep 20, 2024 A106730
J2410419Certificate of AnalysisSep 20, 2024 A106730
J2410420Certificate of AnalysisSep 20, 2024 A106730
A2514182Certificate of AnalysisJul 19, 2024 A106730
G2424263Certificate of AnalysisJul 01, 2024 A106730
G2424159Certificate of AnalysisJul 01, 2024 A106730
G2424156Certificate of AnalysisJul 01, 2024 A106730
G2424157Certificate of AnalysisJul 01, 2024 A106730
G2424158Certificate of AnalysisJul 01, 2024 A106730
G2404131Certificate of AnalysisJun 17, 2024 A106730
C2421106Certificate of AnalysisMar 05, 2024 A106730
C2421105Certificate of AnalysisMar 05, 2024 A106730
C2421104Certificate of AnalysisMar 05, 2024 A106730
C2414085Certificate of AnalysisMar 05, 2024 A106730
C2401098Certificate of AnalysisJan 18, 2024 A106730
C2401099Certificate of AnalysisJan 18, 2024 A106730
L2214645Certificate of AnalysisJan 17, 2023 A106730
G2329063Certificate of AnalysisDec 30, 2022 A106730
G2329059Certificate of AnalysisDec 30, 2022 A106730
G2329054Certificate of AnalysisDec 30, 2022 A106730
I1825017Certificate of AnalysisJul 20, 2022 A106730
B2207130Certificate of AnalysisDec 28, 2021 A106730
B2207118Certificate of AnalysisDec 28, 2021 A106730
B2207117Certificate of AnalysisDec 28, 2021 A106730
B2207068Certificate of AnalysisDec 28, 2021 A106730
H2309514Certificate of AnalysisSep 07, 2021 A106730

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Chemical and Physical Properties
SolubilitySoluble in water and methanol.
SensitivityHygroscopic
Melt Point(°C)153-157°C
Molecular Weight444.600 g/mol
XLogP3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count18
Exact Mass444.216 Da
Monoisotopic Mass444.216 Da
Topological Polar Surface Area118.000 Ų
Heavy Atom Count29
Formal Charge0
Complexity546.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count3
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count2
Documents & Articles
Citations of This Product
References
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49. Yuze Zhou, Jiaying Lei, Jing Peng, Tengling Ye, Yumeng Wang, Ruipeng Huang, Yubo Zhang, Yonghui Ren, Yuhong Zhou, Dongyan Tang.  (2024)  Carboxyl-functionalized dual pH/temperature-responsive poly(N-vinylcaprolactam) microgels based on isogenous comonomers for smart window applications.  JOURNAL OF COLLOID AND INTERFACE SCIENCE,      [PMID:39226748] [10.1016/j.jcis.2024.08.261]
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