3-Methylbutyl decanoate

Basic Information

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CAS Number

2306-91-4

Molecular Formula

C15H30O2

Molecular Weight

242.4 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

Boiling Point

124°C/3mmHg

Flash Point

125 ºC

Refractive Index

1.4310-1.4330

SMILES

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CCCCCCCCCC(OCCC(C)C)=O

InChI

InChI=1S/C15H30O2/c1-4-5-6-7-8-9-10-11-15(16)17-13-12-14(2)3/h14H,4-13H2,1-3H3

InChIKey

XDOGFYDZGUDBQY-UHFFFAOYSA-N

LogP

4.716400000000005

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

176

Synonyms & References

English

Decanoic acid,3-methylbutyl ester
Isoamyl Decanoate
3-methylbutyl decanoate
Decanoic Acid Isoamyl Ester
decanoic acid isopentyl ester
Decansaeure-isopentylester
iso-Amyl n-decanoate
Isopentyl decanoate
N-CAPRIC ACID ISOAMYL ESTER
Pentadecanoic acid,3-methylbutyl ester
isoamyl caprate
Isopentyl alcohol decanoate
Isopentyl caprate

MDL Number

MFCD00053822

Customs Code

2915900090

FAQ

What is 3-Methylbutyl decanoate (CAS: 2306-91-4)?

3-Methylbutyl decanoate is an ester with the chemical formula C15H30O2. It is a colorless to light yellow liquid with a characteristic aroma. This compound is often used as a fragrance ingredient in cosmetics and perfumes due to its pleasant scent.

What are the main uses of 3-Methylbutyl decanoate (CAS: 2306-91-4)?

3-Methylbutyl decanoate is primarily used as a fragrance ingredient in the cosmetics and perfume industry. It is also utilized as a flavor enhancer in food products and as a solvent in various applications, including industrial cleaning and coating formulations.

Is 3-Methylbutyl decanoate (CAS: 2306-91-4) safe?

3-Methylbutyl decanoate is considered safe for use in cosmetics and food products when used in accordance with regulatory guidelines. However, it is important to follow safety precautions such as wearing gloves and goggles when handling the compound to prevent skin and eye irritation. Inhalation should be avoided, and it should be stored in a cool, dry place away from direct sunlight.

How should 3-Methylbutyl decanoate (CAS: 2306-91-4) be stored?

3-Methylbutyl decanoate should be stored in a cool, dry place, away from direct sunlight and heat sources to prevent degradation. It should be kept in a sealed container to maintain purity. Avoid exposure to moisture and store in a well-ventilated area to prevent the risk of fire and ensure proper air circulation.