2,2,4-Trimethylpentane-1,3-diyl bis(2-methylpropanoate)

Basic Information

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CAS Number

6846-50-0

Molecular Formula

C16H30O4

Molecular Weight

286.41 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

−70 °C

Boiling Point

280 °C

Density

0.941 g/mL at 25 °C

Refractive Index

n20/D 1.434(lit.)

SMILES

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CC(C)C(OC(C(C)C)=O)C(C)(C)COC(C(C)C)=O

InChI

InChI=1S/C16H30O4/c1-10(2)13(20-15(18)12(5)6)16(7,8)9-19-14(17)11(3)4/h10-13H,9H2,1-8H3

InChIKey

OMVSWZDEEGIJJI-UHFFFAOYSA-N

LogP

3.4356000000000027

Topological Polar Surface Area

52.6 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

329

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Explosive Limit

0.48%, 172°F

Synonyms & References

English

2,2,4-Trimethylpentane-1,3-diyl bis(2-methylpropanoate)
2,2,4-Trimethyl-1,3-pentanediol diisobutyrate
2,2,4-Trimethyl-1,3-
TXIB
1,3-bis-isobutyryloxy-2,2,4-trimethyl-pentane
1,3-Pentanediol,2,2,4-trimethyl-,diis
2,2,4-TRI
2,2,4-TRIMETHYL-1,2-DIHYDRO-QUINOLIN-6-OL
2,2,4-trimethyl-1,3-pentandiol diisobutyrate
2,2,4-TRIMETHYL-1,3-PENTANEDIOL DIISO-BU
2,2,4-trimethyl-1,3-pentanediol-diisobutyrate
2,2,4-TRIMETHYL-1,3-PENTANEDIOL-ISOBUTYRATE
2,2,4-trimethyl-1,3-pentanediyl diisobutyrate
DNTXIB
kodaflextxib
PROSOLVE DE
TEXANOL ISOBUTYRATE
TRIMETHYL PENTANYL DIISOBUTYRATE
1-Isopropyl-2,2-dimethyltrimethylene diisobutyrate
Kodaflex txib
Propanoic acid, 2-methyl-, 2,2-dimethyl-1-(1-methylethyl)-1,3-propanediyl ester
2,2,4-Trimethylpentanediol-1,3-diisobutyrate
Isobutyric acid, 1-isopropyl-2,2-dimethyltrimethylene ester
2,2,4-Trimethyl-1,3-pentanediol ester
AK116054
DSSTox_CID_7635
2,2,4-Trimethyl-1,3-pentadien
2,2,4-trimethyl-1,3-pentanediol diisobutyrate

MDL Number

MFCD00059267

Customs Code

2915900090

FAQ

What is 2,2,4-Trimethylpentane-1,3-diyl bis(2-methylpropanoate) (CAS: 6846-50-0)?

2,2,4-Trimethylpentane-1,3-diyl bis(2-methylpropanoate) is a colorless, clear liquid with a molecular formula of C12H24O2. It is used in various applications, including as a solvent and in pharmaceuticals. This compound is known for its low toxicity and good stability.

What are the main uses of 2,2,4-Trimethylpentane-1,3-diyl bis(2-methylpropanoate) (CAS: 6846-50-0)?

This compound is primarily used as a solvent and in the pharmaceutical industry for the production of certain drugs. It is also utilized in research applications where its chemical properties make it suitable for specific reactions and processes.

Is 2,2,4-Trimethylpentane-1,3-diyl bis(2-methylpropanoate) (CAS: 6846-50-0) safe?

Yes, this compound is considered safe with low toxicity. However, it is important to handle it with care, wearing appropriate personal protective equipment (PPE) such as gloves and goggles. Store it in a well-ventilated area and avoid inhaling vapors. Follow local safety regulations and guidelines.

How should 2,2,4-Trimethylpentane-1,3-diyl bis(2-methylpropanoate) (CAS: 6846-50-0) be stored?

Store this compound in a cool, dry place away from direct sunlight and heat sources. Keep it in a tightly sealed container to prevent evaporation and contamination. Ensure the storage area has good ventilation to avoid the buildup of flammable vapors. Maintain a stable temperature between 15-25°C (59-77°F) and avoid exposing it to moisture or humidity.