Ethyl 2,4-dichloro-3-oxobutanoate

Basic Information

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CAS Number

88-00-6

Molecular Formula

C6H8Cl2O3

Molecular Weight

199.03 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

SMILES

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CCOC(=O)C(Cl)C(=O)CCl

InChI

InChI=1S/C6H8Cl2O3/c1-2-11-6(10)5(8)4(9)3-7/h5H,2-3H2,1H3

InChIKey

GPDFVBIDCBPHSW-UHFFFAOYSA-N

LogP

0.9647999999999999

Topological Polar Surface Area

43.370000000000005 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Synonyms & References

English

Butanoic acid,2,4-dichloro-3-oxo-, ethyl ester
ethyl 2,4-dichloro-3-oxobutanoate
ethyl 2,4-dichloro-3-oxobutyrate
Acetoacetic acid, 2,4-dichloro-, ethyl ester (8CI)
Ethyl 2,4-dichloro-3-oxobutanoate (ACI)
2,4-Dichloroacetoacetic acid ethyl ester
Ethyl 2,4-dichloroacetoacetate

MDL Number

MFCD00129107

FAQ

What regulatory guidelines apply to Ethyl 2,4-dichloro-3-oxobutanoate (CAS: 88-00-6)?

Ethyl 2,4-dichloro-3-oxobutanoate (CAS: 88-00-6) falls under the European Union’s REACH regulations for chemicals placed on the market. It must comply with the Globally Harmonized System of Classification and Labeling of Chemicals (GHS) for hazard communication. In the USA, it is also subject to FDA and EPA regulations concerning the use and disposal of such compounds.

Are there alternatives to Ethyl 2,4-dichloro-3-oxobutanoate (CAS: 88-00-6) in synthesis?

There are alternative reagents that can be used in synthesis, such as ethyl 2,4-dichlorobutanoate or ethyl 2,4-dichloro-3-hydroxybutanoate. Depending on the specific reaction conditions and desired product, these can serve as viable substitutes.

What is the market or research trend for Ethyl 2,4-dichloro-3-oxobutanoate (CAS: 88-00-6)?

Research on Ethyl 2,4-dichloro-3-oxobutanoate (CAS: 88-00-6) is primarily focused on its applications in organic synthesis and as a precursor in pharmaceutical and agricultural industries. Market trends indicate increasing interest in sustainable and environmentally friendly approaches, which may drive further research into alternative synthesis methods and uses.

How should waste containing Ethyl 2,4-dichloro-3-oxobutanoate (CAS: 88-00-6) be handled?

Waste containing Ethyl 2,4-dichloro-3-oxobutanoate (CAS: 88-00-6) should be collected and disposed of in accordance with local and national regulations. Proper waste management includes ensuring the waste is neutralized or treated to reduce its hazardous properties. Incineration or professional waste disposal services are recommended to ensure compliance with environmental protection standards.