CAS 17159-79-4

Ethyl 4-oxocyclohexanecarboxylate

Description:

Ethyl 4-oxocyclohexanecarboxylate, with the CAS number 17159-79-4, is an organic compound characterized by its ester functional group and a cyclohexane ring. This compound features a carbonyl group (C=O) adjacent to the cyclohexane, contributing to its reactivity and potential applications in organic synthesis. It is typically a colorless to pale yellow liquid with a pleasant odor, indicating its volatility and potential use as a solvent or in fragrance formulations. Ethyl 4-oxocyclohexanecarboxylate is soluble in organic solvents, making it useful in various chemical reactions, particularly in the synthesis of more complex molecules. Its structure allows for various chemical transformations, including nucleophilic additions and condensation reactions. As with many organic compounds, safety precautions should be taken when handling it, as it may pose health risks if inhaled or ingested. Overall, this compound is of interest in both academic research and industrial applications due to its versatile chemical properties.

Formula: C₉H₁₄O₃

InChI: InChI=1S/C9H14O3/c1-2-12-9(11)7-3-5-8(10)6-4-7/h7H,2-6H2,1H3

InChI key: InChIKey=ZXYAWONOWHSQRU-UHFFFAOYSA-N

SMILES: C(OCC)(=O)C1CCC(=O)CC1

Synonyms:

• 4-(Ethoxycarbonyl)-1-cyclohexanone
• 4-Carboethoxycyclohexanone
• 4-Cyclohexanonecarboxylic acid ethyl ester
• 4-Ethoxycarbonylcyclohexanone
• 4-Oxocyclohexane-1-carboxylic acid ethyl ester
• 4-Oxocyclohexanecarboxylic acid ethyl ester
• Cyclohexanecarboxylic acid,4-oxo-,ethyl ester
• Ethyl 4-Cyclohexanonecarboxylate
• Ethyl 4-Oxo-Cyclohexanecarboxylate
• Ethyl 4-Oxocyclohexancarboxylate
• Ethyl 4-ketocyclohexylcarboxylate
• Ethyl 4-oxocyclohexan-1-carboxylate
• Ethyl 4-oxocyclohexane carboxylate
• Ethyl 4-oxocyclohexane-1-carboxylate
• Ethyl cyclohexanone-4-carboxylate
• NSC 250674

Ethyl 4-Oxocyclohexanecarboxylate

CAS: 17159-79-4

Formula: C₉H₁₄O₃

Purity: >98.0%(GC)

Color and Shape: Colorless to Light yellow to Light orange clear liquid

Molecular weight: 170.21

Ref: 3B-C1530

Ethyl 4-oxocyclohexanecarboxylate, 97%

CAS: 17159-79-4

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: C₉H₁₄O₃

Purity: 97%

Color and Shape: Liquid, Clear colorless to pale yellow

Molecular weight: 170.21

Ref: 02-B20572

Ethyl 4-Oxocyclohexanecarboxylate

CAS: 17159-79-4

Formula: C₉H₁₄O₃

Purity: 97%

Color and Shape: Liquid

Molecular weight: 170.2057

Ref: IN-DA0034VH

Ethyl 4-oxocyclohexane-1-carboxylate

CAS: 17159-79-4

Ethyl 4-oxocyclohexane-1-carboxylate

Formula: C₉H₁₄O₃

Purity: 98%

Color and Shape: clear. almost colourless liquid

Molecular weight: 170.21g/mol

Ref: 54-OR5848

Ethyl-4-oxocyclohexane carboxylate

CAS: 17159-79-4

Formula: C₉H₁₄O₃

Purity: 98.00%

Color and Shape: Liquid

Molecular weight: 170.208

Ref: 10-F032733

Ethyl 4-Oxocyclohexanecarboxylate

Controlled Product

CAS: 17159-79-4

Applications A cyclohexanone derivative used in the study of cyclohexanone monooxygenase and its mutants as catalysts.
References Rial, D.V. et al.: Eur. J. Org. Chem., 7, 1203 (2008); Kayser, M.M. et al.: J. Org. Chem., 71, 8424 (2006);

Formula: C₉H₁₄O₃

Color and Shape: Neat

Molecular weight: 170.21

Ref: TR-E925360