2-Ethylhexyl octanoate

Basic Information

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CAS Number

63321-70-0

Molecular Formula

C16H32O2

Molecular Weight

256.43 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

SMILES

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CCCCCCCC(OCC(CC)CCCC)=O

InChI

InChI=1S/C16H32O2/c1-4-7-9-10-11-13-16(17)18-14-15(6-3)12-8-5-2/h15H,4-14H2,1-3H3

InChIKey

HPUAIVNIHNEYPO-UHFFFAOYSA-N

LogP

5.106500000000006

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

190

Synonyms & References

English

Octanoic acid,2-ethylhexyl ester
2-ETHYLHEXYL OCTANOATE
2-Ethylhexyl caprylate
Octanoic acid, 2-ethylhexyl ester
2-Ethylhexyl octanoate #
Caprylic acid 2-ethylhexyl ester
HPUAIVNIHNEYPO-UHFFFAOYSA-N
NSC403894

MDL Number

MFCD12031480

FAQ

What regulatory guidelines apply to 2-Ethylhexyl octanoate (CAS: 63321-70-0)?

2-Ethylhexyl octanoate (CAS: 63321-70-0) is subject to various regulatory guidelines including the Globally Harmonized System of Classification and Labeling of Chemicals (GHS), REACH regulations for substances manufactured or imported into the European Union, and FDA and EPA requirements for use in food and environmental safety contexts.

Are there alternatives to 2-Ethylhexyl octanoate (CAS: 63321-70-0) in synthesis?

There are several alternatives to 2-Ethylhexyl octanoate (CAS: 63321-70-0) in synthesis, including other esters like ethyl hexanoate and butyl octanoate, which may be used depending on the specific application and desired properties.

What is the market or research trend for 2-Ethylhexyl octanoate (CAS: 63321-70-0)?

The market for 2-Ethylhexyl octanoate (CAS: 63321-70-0) is growing, driven by increasing demand in the fragrance and flavor industry. Research trends focus on exploring its use in natural product synthesis and as a sustainable alternative to synthetic fragrances.

How should waste containing 2-Ethylhexyl octanoate (CAS: 63321-70-0) be handled?

Waste containing 2-Ethylhexyl octanoate (CAS: 63321-70-0) should be collected in appropriate containers and disposed of through professional waste disposal services that adhere to local hazardous waste regulations. Environmental protection measures include ensuring no discharge into water bodies and proper incineration for disposal of larger quantities.