Bis(6-methylheptyl) sebacate

Basic Information

View in Editor

CAS Number

27214-90-0

Molecular Formula

C26H50O4

Molecular Weight

426.68 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Surfactants Anionic Surfactants

Polymers and Plastics Thermoplastics Polyolefins

Basic Physical Properties

Boiling Point

225 °C / 2mmHg

Flash Point

215°C

SMILES

View in Editor

CC(C)CCCCCOC(=O)CCCCCCCCC(=O)OCCCCCC(C)C

InChI

InChI=1S/C26H50O4/c1-23(2)17-11-9-15-21-29-25(27)19-13-7-5-6-8-14-20-26(28)30-22-16-10-12-18-24(3)4/h23-24H,5-22H2,1-4H3

InChIKey

ZWYAVGUHWPLBGT-UHFFFAOYSA-N

LogP

7.626400000000009

Topological Polar Surface Area

52.60000000000001 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

366

Synonyms & References

English

Bis(6-methylheptyl) decanedioate
DOS
dioctyl sebacate
Sebacicaciddioctylester
Sebacic acid di-n-octyl ester
Diisooctyl sebacate
Di-n-octyl Sebacate
Decanedioicacid,diisooctylester
DiisooCLyl sebacate
diisooctyl
di-n-octyl decanedioate
Isooctyl octadecanoate
Sebacic acid diisooctyl ester

MDL Number

MFCD00152437

FAQ

What is Bis(6-methylheptyl) sebacate (CAS: 27214-90-0)?

Bis(6-methylheptyl) sebacate is a synthetic ester compound with the chemical formula C16H30O4. It is a white, waxy solid with low solubility in water but moderate solubility in organic solvents. Known for its plasticizing properties, it is commonly used as a lubricant and in polymer formulations. The CAS number 27214-90-0 identifies this specific compound in chemical databases.

What are the main uses of Bis(6-methylheptyl) sebacate (CAS: 27214-90-0)?

Bis(6-methylheptyl) sebacate (CAS: 27214-90-0) serves as a plasticizer in the production of flexible plastics, rubber, and coatings. It is also utilized in pharmaceuticals to improve tablet disintegration and in industrial applications for lubrication. Its compatibility with various materials makes it valuable in research for developing new polymer-based products.

Is Bis(6-methylheptyl) sebacate (CAS: 27214-90-0) safe?

Bis(6-methylheptyl) sebacate (CAS: 27214-90-0) is generally considered safe when handled properly, with low acute toxicity. However, prolonged skin contact or inhalation may cause irritation, so protective measures like gloves and ventilation are recommended. Safety standards emphasize adherence to chemical handling protocols to ensure minimal risk in industrial and laboratory settings.

How should Bis(6-methylheptyl) sebacate (CAS: 27214-90-0) be stored?

Bis(6-methylheptyl) sebacate (CAS: 27214-90-0) should be stored in a cool, dry, and dark place, preferably at temperatures below 25°C. It requires a sealed container to prevent moisture absorption and contamination. Avoid exposure to heat or direct sunlight to maintain stability and prolong shelf life. Proper storage ensures safety and effectiveness in applications.