CAS 10137-67-4

Propanoic acid, 3-cyano-, ethyl ester

Description:

Propanoic acid, 3-cyano-, ethyl ester, also known as ethyl 3-cyano-propanoate, is an organic compound characterized by its ester functional group and a cyano group attached to the propanoic acid backbone. It typically appears as a colorless to pale yellow liquid with a fruity odor. This compound is soluble in organic solvents and exhibits moderate polarity due to the presence of both the ester and cyano groups. Its molecular structure contributes to its reactivity, making it useful in various chemical syntheses, particularly in the production of pharmaceuticals and agrochemicals. The presence of the cyano group enhances its utility in nucleophilic reactions, while the ethyl ester moiety can participate in esterification and transesterification processes. Additionally, propanoic acid derivatives are known for their applications in flavoring and fragrance industries. Safety data indicates that it should be handled with care, as it may cause irritation to the skin and eyes. Overall, this compound is significant in organic synthesis and industrial applications.

Formula: C₆H₉NO₂

InChI: InChI=1S/C6H9NO2/c1-2-9-6(8)4-3-5-7/h2-4H2,1H3

InChI key: InChIKey=BFSBTNGKMMFQNL-UHFFFAOYSA-N

SMILES: C(CCC#N)(OCC)=O

Synonyms:

• 3-Cyanopropanoic acid ethyl ester
• 3-Cyanopropionic acid, ethyl ester
• Ethyl 3-cyanopropionate
• NSC 94973
• Propanoic Acid, 3-Cyano-, Ethyl Ester
• Propanoic acid, 3-cyano-, ethyl ester (9CI)
• Propionic acid, 3-cyano-, ethyl ester
• Ethyl 3-cyanopropanoate

Propanoic acid, 3-​cyano-​, ethyl ester

CAS: 10137-67-4

Formula: C₆H₉NO₂

Purity: 97%

Color and Shape: Liquid

Molecular weight: 127.1412

Ref: IN-DA0004BP

Ethyl 3-cyanopropanoate

CAS: 10137-67-4

Ethyl 3-cyanopropanoate

Purity: 95%

Molecular weight: 127.14g/mol

Ref: 54-OR946046

Ethyl 3-cyanopropanoate

CAS: 10137-67-4

Ethyl 3-cyanopropanoate is an organic compound with the formula CH3C(O)CH2CN. It is a colorless liquid that boils at 100 °C. It is used in the synthesis of other organic compounds, such as oxazolidinones, cyclopropenes, and quinolizines. The yield can be increased to 98% by using a catalyst such as potassium tert-butoxide or zinc chloride in the reaction. The reaction proceeds through an elimination followed by an acid-catalyzed alkylation to afford the desired product. This process also results in a high yield of ethyl bromoacetate as a side product.

Formula: C₆H₉NO₂

Purity: Min. 95%

Color and Shape: Powder

Molecular weight: 127.14 g/mol

Ref: 3D-FE125162

ETHYL 3-CYANOPROPANOATE

CAS: 10137-67-4

Formula: C₆H₉NO₂

Purity: 97%

Color and Shape: Liquid

Molecular weight: 127.143

Ref: 10-F332295