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Aerosol OT - 70%,methanol10-20%, high purity , CAS No.577-11-7

    Grade & Purity:
  • ≥70%
  • methanol 10-20%
In stock
Item Number
A196243
Grouped product items
SKU Size
Availability
Price Qty
A196243-500g
500g
Available within 4-8 weeks(?)
Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!
$154.90

Basic Description

Synonyms AOT | DOSS | Bloat treatment | Ins-480 | MFCD00012455 | Nikkol otp-75 | Requtol | Dioctyl | Diotilan | Docusato sodico [INN-Spanish] | DTXCID102959 | Dioctyl sulfosuccinate sodium salt | Manoxal OT | Solusol-75% | 2-Ethylhexyl sulfosuccinate sodium | Alka
Specifications & Purity ≥70%, methanol 10-20%
Storage Temp Argon charged
Shipped In Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
Superclass Lipids and lipid-like molecules
Class Fatty Acyls
Subclass Fatty acid esters
Intermediate Tree Nodes Not available
Direct Parent Fatty 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 Framework Aliphatic 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
Description This 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

Associated Targets(Human)

VDR Tclin Vitamin D receptor (26531 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
PPARG Tclin Peroxisome proliferator-activated receptor gamma (15191 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
PPARA Tclin Peroxisome proliferator-activated receptor alpha (9197 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
RXRA Tclin Retinoid X receptor alpha (3637 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (345557 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

Mechanisms of Action

Mechanism of Action Action Type target ID Target Name Target Type Target Organism Binding Site Name References

Names and Identifiers

IUPAC Name sodium;1,4-bis(2-ethylhexoxy)-1,4-dioxobutane-2-sulfonate
INCHI 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
InChIKey APSBXTVYXVQYAB-UHFFFAOYSA-M
Smiles CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)[O-].[Na+]
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=

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.

2 results found

Lot Number Certificate Type Date Item
D2116011 Certificate of Analysis Jan 04, 2024 A196243
C2307558 Certificate of Analysis Mar 10, 2023 A196243

Chemical and Physical Properties

Sensitivity Under Inert Atmosphere
Melt Point(°C) 153-157°C
Molecular Weight 444.600 g/mol
XLogP3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 18
Exact Mass 444.216 Da
Monoisotopic Mass 444.216 Da
Topological Polar Surface Area 118.000 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 546.000
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 3
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
The total count of all stereochemical bonds 0
Covalently-Bonded Unit Count 2

Citations of This Product

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