CAS 3249-68-1

Ethyl 3-oxohexanoate

Description:

Ethyl 3-oxohexanoate, also known as ethyl 3-oxocaproate, is an organic compound characterized by its ester functional group and a ketone moiety. It typically appears as a colorless to pale yellow liquid with a fruity odor, making it appealing for use in flavoring and fragrance applications. The compound has a molecular formula that reflects its structure, which includes a six-carbon chain with a ketone group at the third position and an ethyl ester group. Ethyl 3-oxohexanoate is soluble in organic solvents and exhibits moderate solubility in water, which is common for esters. It is often utilized in organic synthesis, particularly in the production of various pharmaceuticals and agrochemicals, due to its reactivity and ability to participate in condensation reactions. Additionally, it may serve as an intermediate in the synthesis of more complex molecules. Safety data indicates that, like many organic compounds, it should be handled with care, as it may cause irritation upon contact with skin or eyes.

Formula: C₈H₁₄O₃

InChI: InChI=1/C8H14O3/c1-3-5-7(9)6-8(10)11-4-2/h3-6H2,1-2H3

InChI key: InChIKey=KQWWVLVLVYYYDT-UHFFFAOYSA-N

SMILES: C(CC(OCC)=O)(CCC)=O

Synonyms:

• 3-Oxohexanoic acid ethyl ester
• Butyrylacetic acid ethyl ester
• Butyrylacetic acid ethyl ester~Ethyl 3-oxohexanoate~3-Oxohexanoic acid ethyl ester
• Caproic acid, β-oxo-, ethyl ester
• Ethyl 3-ketohexanoate
• Ethyl 3-oxohexanoate
• Ethyl 3-propyl-3-oxopropanoate
• Ethyl butyroacetate
• Ethyl butyroylacetate
• Ethyl α-butyrylacetate
• Hexanoic acid, 3-oxo-, ethyl ester
• NSC 42868
• Ethyl butyrylacetate
• FEMA 3683
• ETHYL 3-OXOHEXANOATE 98+%
• Ehtyl butyryl acetate
• Ethyl alpha-butyrylacetate
• AKOS 220-93
• ETHYL BUTYROYL ACETATE
• ETHYL B-KETOCAPROATE
• 3-oxo-hexanoicaciethylester
• ERHYL BUTYRYLACETATE
• 3-KETOHEXANOIC ACID ETHYL ESTER
• 3-KETO-N-HEXANOIC ACID ETHYL ESTER
• Ethylbutyrylacetate,98%

Ethyl butyrylacetate, 98%

CAS: 3249-68-1

This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has not changed as a part of the brand transition to Thermo Sci

Formula: C₈H₁₄O₃

Purity: 98%

Color and Shape: Clear colorless to pale yellow, Liquid

Molecular weight: 158.20

Ref: 02-A12786

ETHYL BUTYRYLACETATE

CAS: 3249-68-1

Formula: C₈H₁₄O₃

Purity: 96%

Color and Shape: Liquid

Molecular weight: 158.1950

Ref: IN-DA003QEG

Ethyl 3-oxohexanoate

CAS: 3249-68-1

Ethyl 3-oxohexanoate

Formula: C₈H₁₄O₃

Purity: 95%

Color and Shape: colourless liquid

Molecular weight: 158.19g/mol

Ref: 54-OR28623

Ethyl butyrylacetate

CAS: 3249-68-1

Ethyl butyrylacetate is a ketone ester compound widely used in biochemical experiments and drug synthesis research.

Formula: C₈H₁₄O₃

Purity: 99.44%

Color and Shape: Solid

Molecular weight: 158.2

Ref: TM-TCL-00040

Ethyl 3-Oxohexanoate

CAS: 3249-68-1

Formula: C₈H₁₄O₃

Purity: >95.0%(GC)

Color and Shape: Colorless to Light yellow clear liquid

Molecular weight: 158.20

Ref: 3B-K0030

Ethyl 3-oxohexanoate

CAS: 3249-68-1

Formula: C₈H₁₄O₃

Purity: 95%

Color and Shape: Liquid

Molecular weight: 158.197

Ref: 10-F094679

Ethyl Butyrylacetate-d5

Controlled Product

CAS: 3249-68-1

Formula: C₈D₅H₉O₃

Color and Shape: Neat

Molecular weight: 163.226

Ref: TR-E900702

Ethyl 3-Oxohexanoate

CAS: 3249-68-1

Ethyl 3-Oxohexanoate is a fatty acid that is used in cell culture as a hydroxyl group donor. It has been shown to have anticancer activity against human breast cancer cells. The anticancer activity of ethyl 3-oxohexanoate may be due to its ability to form diazonium salt, which reacts with chloride ions to form an aliphatic hydrocarbon. This reaction releases an active methylene group, which can react with the coumarin derivatives of the diazonium salt to form structural analysis and reaction intermediates.

Formula: C₈H₁₄O₃

Purity: Min. 95%

Molecular weight: 158.19 g/mol

Ref: 3D-FE60060