diisooctyl sebacate
Product Information
Molecular Formula
C26H50O4
Molecular Weight
426.67
Description
Bis(2-ethylhexyl)sebacate has been used as a platicizer for styrene resins, PVC, nitrocelluloses, and other plastics. Bis(2-ethylhexyl)sebacate has been used in the construction of ion-selective polymeric membrane electrodes.
Synonyms
bis(2-ethylhexyl) decanedioate
IUPAC Name
bis(2-ethylhexyl) decanedioate
SMILES
CCCCC(CC)COC(=O)CCCCCCCCC(=O)OCC(CC)CCCC
InChI
InChI=1S/C26H50O4/c1-5-9-17-23(7-3)21-29-25(27)19-15-13-11-12-14-16-20-26(28)30-22-24(8-4)18-10-6-2/h23-24H,5-22H2,1-4H3
InChI Key
VJHINFRRDQUWOJ-UHFFFAOYSA-N
Boiling Point
212 °C (1 mmHg)
Melting Point
-55 °C
Flash Point
>230 °F
Purity
> 96.0 % (GC)
Density
0.914 g/cm3
Solubility
water, 5.149e-006 mg/L @ 25 °C (est)
Appearance
Clear pale yellow liquid with a mild odor. insoluble in water.
Application
DOS can be used as an aerosol material that can be used to investigate the filtration efficiency of polyvinylidene/silicon oxide (PVDF/SiO2) based fibrous membranes. It may be blended with PVC to form membranes that can be deposited on silver (Ag) based composites which can be used in the fabrication of ion-selective electrodes for chemical analysis. DOS may also be used in combination with PVC, chloride ionophore III, and tridodecylmethylammonium chloride for the development of chloride sensing films.
Storage
2-8 °C
Grade
technical grade
Refractive Index
n20/D 1.450 (lit.)
Stability
Stable. Combustible. Incompatible with strong oxidizing agents.
LogP
7.62640
Vapor Pressure
Vapor pressure, Pa at 37 °C: 0.000024
Decomposition
When heated to decomposition it emits acrid and irritating fumes
Odor
MILD ODOR
Safety Information
Hazards
H413:
May cause long-lasting harmful effects to aquatic life.
May cause long-lasting harmful effects to aquatic life.
Precautionary Statement
P273:
Avoid release to the environment.
P501:
Dispose of contents/container in accordance with local/regional/national/international regulations.
Avoid release to the environment.
P501:
Dispose of contents/container in accordance with local/regional/national/international regulations.
Computed Properties
XLogP3
9
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
23
Exact Mass
426.37091007 g/mol
Monoisotopic Mass
426.37091007 g/mol
Topological Polar Surface Area
52.6Ų
Heavy Atom Count
30
Formal Charge
0
Complexity
370
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
2
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| JP-2022036238-A | Floor lumber | 2022-01-12 |
| CN-113999606-A | Polyurethane waterproof coating and preparation method thereof | 2021-12-30 |
| CN-114133905-A | Organic silicon ceramic tile adhesive and preparation method thereof | 2021-12-28 |
| CN-114133589-A | Novel butyronitrile butadiene styrene composite latex dipping slurry and preparation method thereof | 2021-12-27 |
| JP-2022036169-A | Paint materials consisting of cosmetics, diluents for paint materials, paints and paint sets | 2021-12-27 |
| CN-114133911-A | Solvent-free bi-component polyurethane adhesive and application thereof | 2021-12-23 |
| CN-114105718-A | Coated fine-grained ammonium perchlorate and preparation method and application thereof | 2021-12-22 |
| CN-114149625-A | Low-temperature-resistant plate for cold chain and preparation method thereof | 2021-12-22 |
| CN-114106448-A | Soft low-smoke halogen-free sheath material for wind power cable | 2021-12-21 |
| CN-114163700-A | Radiation-resistant nitrile rubber material for sealing nuclear power plant and preparation method thereof | 2021-12-18 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 22939208 | 2012-10-05 | Lipophilicity screening of novel drug-like compounds and comparison to clog P | Journal of chromatography. A |
| 22752099 | 2012-07-01 | Comparability of portable nanoparticle exposure monitors | The Annals of occupational hygiene |
| 22158973 | 2012-01-28 | The statistical evolution of multiple generations of oxidation products in the photochemical aging of chemically reduced organic aerosol | Physical chemistry chemical physics : PCCP |
| 22524020 | 2012-01-01 | Quartz crystal microbalance sensor using ionophore for ammonium ion detection | Journal of nanoscience and nanotechnology |
| 22862434 | 2012-01-01 | Variation in penetration of submicrometric particles through electrostatic filtering facepieces during exposure to paraffin oil aerosol | Journal of occupational and environmental hygiene |
| 21704764 | 2011-08-05 | Spectrophotometric determination of various polyanions with polymeric film optodes using microtiter plate reader | Analytica chimica acta |
| 21509392 | 2011-06-07 | Potentially important nighttime heterogeneous chemistry: NO3 with aldehydes and N2O5 with alcohols | Physical chemistry chemical physics : PCCP |
| 21237310 | 2011-02-07 | Development of polymer-membrane based electrodes for suramin | Analytica chimica acta |
| 22164107 | 2011-01-01 | Use of a new ziprasidone-selective electrode in mixed solvents and its application in the analysis of pharmaceuticals and biological fluids | Sensors (Basel, Switzerland) |
| 20672336 | 2010-11-01 | Corrosion inhibition with different protective layers in tinplate cans for food preservation | Journal of the science of food and agriculture |
