Ethyl 2-ethyl-3-oxobutanoate

Basic Information

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CAS Number

607-97-6

Molecular Formula

C8H14O3

Molecular Weight

158.2 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Physical Properties

Boiling Point

87-189 °C/743 mmHg

Density

0.981 g/mL at 25 °C

Refractive Index

n20/D 1.421(lit.)

SMILES

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CCOC(=O)C(CC)C(=O)C

InChI

InChI=1S/C8H14O3/c1-4-7(6(3)9)8(10)11-5-2/h7H,4-5H2,1-3H3

InChIKey

OKANYBNORCUPKZ-UHFFFAOYSA-N

LogP

1.1647

Topological Polar Surface Area

43.370000000000005 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

151

Safety Information

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GHS Hazard Pictograms

H227

Hazard Statement

H227 Combustible liquid
Flammable liquids

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

Ethyl 2-ethylacetoacetate
Ethyl 2-ethyl-3-oxobutanoate:Diethyl acetoacetate
Butanoic acid, 2-ethyl-3-oxo-, ethyl ester
2-ETHYLACETOACETIC ACID ETHYL ESTER
Ethyl 2-ethyl-3-oxobutanoate
Ethylethylacetoacetate
2-Acetylbutyric Acid Ethyl Ester
Ethyl 2-Acetylbutyrate
2-Ethyl-3-oxo-butanoic acid ethyl ester
Ethyl 2-ethyl-3-ketobutyrate
Ethyl alpha-ethylacetoacetate
ethyl-2-ethylacetoacetate
2-ethyl-3-oxo-butyric acid ethyl ester
Ethyl .alpha.-acetylbutyrate
ethyl 2-ethyl-3-oxo-butanoate
Ethyl .alpha.-ethylacetoacetate
OKANYBNORCUPKZ-UHFFFAOYSA-N
Ethyl alpha-acetylbutyrate

MDL Number

MFCD00039898

FAQ

What regulatory guidelines apply to Ethyl 2-ethyl-3-oxobutanoate (CAS: 607-97-6)?

Ethyl 2-ethyl-3-oxobutanoate (CAS: 607-97-6) is subject to regulatory guidelines such as the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), REACH regulations in the European Union, and FDA/EPA requirements for chemical safety and environmental impact. Companies must comply with these guidelines for manufacturing, handling, and disposing of the compound.

Are there alternatives to Ethyl 2-ethyl-3-oxobutanoate (CAS: 607-97-6) in synthesis?

There are a few alternatives to Ethyl 2-ethyl-3-oxobutanoate (CAS: 607-97-6) in synthesis, including ethyl 3-oxobutanoate and ethyl 2-methyl-3-oxobutanoate. These alternatives can serve as effective substitutes depending on the specific reaction conditions and desired product purity.

What is the market or research trend for Ethyl 2-ethyl-3-oxobutanoate (CAS: 607-97-6)?

The market for Ethyl 2-ethyl-3-oxobutanoate (CAS: 607-97-6) is driven by its use in flavor and fragrance industries. Research trends indicate a growing interest in sustainable and natural alternatives, which could influence the demand for this compound. Additionally, there is ongoing exploration of its potential applications in pharmaceuticals and agrochemicals.

How should waste containing Ethyl 2-ethyl-3-oxobutanoate (CAS: 607-97-6) be handled?

Waste containing Ethyl 2-ethyl-3-oxobutanoate (CAS: 607-97-6) should be collected in appropriate containers and stored in a well-ventilated area. Professional waste disposal services should be utilized for safe incineration or other disposal methods to ensure compliance with environmental protection laws and minimize environmental impact.