Dibutyl adipate

Basic Information

View in Editor

CAS Number

105-99-7

Molecular Formula

C14H26O4

Molecular Weight

258.36 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

Basic Physical Properties

Melting Point

-32°C

Boiling Point

305°C

Refractive Index

n20/D 1.436(lit.)

SMILES

View in Editor

CCCCOC(=O)CCCCC(=O)OCCCC

InChI

InChI=1S/C14H26O4/c1-3-5-11-17-13(15)9-7-8-10-14(16)18-12-6-4-2/h3-12H2,1-2H3

InChIKey

XTJFFFGAUHQWII-UHFFFAOYSA-N

LogP

3.2334000000000023

Topological Polar Surface Area

52.60000000000001 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

202

Safety Information

View Safety Information

Hazard Statement

H361 Suspected of damaging fertility or the unborn child
Reproductive toxicity

H411 Toxic to aquatic life with long lasting effects
Hazardous to the aquatic environment, long-term hazard

Hazard Class

Class 9 Class 9

Synonyms & References

English

dibutyl adipate
DBA
Adipic acid Di-n-butyl ester
Adipic Acid Dibutyl Ester
dibutyl hexanedioate
Hexanedioic acid dibutyl ester
3ps
cetiolb
unitolateb
Adimoll DB
Butyl adipate
Dibutyladipat
dlbutyladipate
3 PS
Cetiol B

MDL Number

MFCD00009451

Customs Code

2917120090

FAQ

What is Dibutyl adipate (CAS: 105-99-7)?

Dibutyl adipate, with the CAS number 105-99-7, is an ester of adipic acid and butanol. It has the chemical formula C12H24O4 and is commonly used as a plasticizer due to its ability to increase the flexibility and workability of materials. It is a colorless liquid with a faint ester odor and is soluble in many organic solvents.

What are the main uses of Dibutyl adipate (CAS: 105-99-7)?

Dibutyl adipate is widely used in the plastics industry as a plasticizer for polyvinyl chloride (PVC) to enhance flexibility. It also finds applications in pharmaceuticals, as a component in some drug formulations, and in research for chemical synthesis. Additionally, it is used in the production of coatings, inks, and adhesives.

Is Dibutyl adipate (CAS: 105-99-7) safe?

Dibutyl adipate is generally considered safe when handled properly, but it should be used with caution. It is classified as a low-toxicity compound, though prolonged exposure may cause irritation. Safety standards recommend using appropriate protective equipment, such as gloves and goggles, and ensuring proper ventilation during handling.

How should Dibutyl adipate (CAS: 105-99-7) be stored?

Dibutyl adipate should be stored in a cool, dry, and well-ventilated area, away from direct sunlight. It is stable under normal storage conditions but should be kept in a sealed container to prevent evaporation. Maintaining a temperature range of 10–25°C and avoiding moisture exposure is recommended for long-term preservation.