101341-45-1

Basic information

• Product Name: 3-(4-CYANO-PHENYL)-3-OXO-PROPIONIC ACID METHYL ESTER
• Synonyms: 3-(4-CYANO-PHENYL)-3-OXO-PROPIONIC ACID METHYL ESTER;4-CYANO-BETA-OXO-BENZENEPROPANOIC ACID METHYL ESTER;4-Cyano-b-oxo-benzenepropanoic acid methyl ester
• CAS NO: 101341-45-1
• Molecular Formula: C₁₁H₉NO₃
• Molecular Weight: 203.19
• Mol File: 101341-45-1.mol

Chemical Properties

• Melting Point: 98-99°C
• Appearance: /
• CAS DataBase Reference: 3-(4-CYANO-PHENYL)-3-OXO-PROPIONIC ACID METHYL ESTER(CAS DataBase Reference)
• NIST Chemistry Reference: 3-(4-CYANO-PHENYL)-3-OXO-PROPIONIC ACID METHYL ESTER(101341-45-1)
• EPA Substance Registry System: 3-(4-CYANO-PHENYL)-3-OXO-PROPIONIC ACID METHYL ESTER(101341-45-1)

Safety Data

• Hazardous Substances Data: 101341-45-1(Hazardous Substances Data)

Usage

Uses

Used in Pharmaceutical Industry:
3-(4-CYANO-PHENYL)-3-OXO-PROPIONIC ACID METHYL ESTER is used as a key intermediate for the synthesis of various pharmaceuticals. Its unique structure allows for the development of new drugs with potential therapeutic applications.
Used in Agrochemical Industry:
3-(4-CYANO-PHENYL)-3-OXO-PROPIONIC ACID METHYL ESTER is used as a building block in the synthesis of agrochemicals. Its versatility in organic synthesis enables the creation of a wide range of products for agricultural applications, such as pesticides and herbicides.
Used in Organic Synthesis:
3-(4-CYANO-PHENYL)-3-OXO-PROPIONIC ACID METHYL ESTER is used as a versatile building block in organic synthesis. Its structure allows for the creation of a diverse range of functionalized products, making it a valuable compound for research and development in various industries.
Used in Medicinal Chemistry:
3-(4-CYANO-PHENYL)-3-OXO-PROPIONIC ACID METHYL ESTER is used in medicinal chemistry for the development of new pharmaceutical compounds. Its unique structure and stability make it an ideal candidate for creating innovative drugs with potential therapeutic benefits.

Upstream product

• 1443-80-7 4-cyanophenyl methyl ketone 
• 616-38-6 carbonic acid dimethyl ester 
• 623-00-7 4-bromobenzenecarbonitrile 
• 38330-80-2 monomethyl monopotassium malonate 
• 82102-37-2 9-methyl-9H-fluorene-9-carbonyl chloride 
• 79-20-9 acetic acid methyl ester 
• 1129-35-7 4-cyanobenzoic acid methyl ester 

Downstream Products

• 1431934-81-4 methyl 6-(4-cyanophenyl)-2,3-diphenyl-2H-1,4-oxazine-5-carboxylate 
• 1613145-26-8 (4-cyanophenyl)carbamoyl azide 

Relevant articles and documents

Iron-catalysed 1,2-acyl migration of tertiary α-azido ketones and 2-azido-1,3-dicarbonyl compounds

Iron-catalysed 1,2-acyl migration of tertiary α-azido ketones and 2-azido-1,3-dicarbonyl compounds provides a simple and atom-economical approach toward enamides and isoquinolones. This paper reports two catalyst systems for these transformations which employ iron(ii) complexes [Fe(dpbz)]Br2 (dpbz = 1,2-bis(diphenylphosphino)benzene) and FeBr2/Et3N, respectively. [Fe(dpbz)]Br2 was found to be highly effective at converting 2-azido-2,3-dihydro-1H-inden-1-ones to isoquinolones. The reagent combination of FeBr2/Et3N, on the other hand, exhibited a broader catalytic scope, owing to the beneficial effect of Et3N. This latter catalyst system enables 2-azido-2-methyl-1,3-dicarbonyl compounds to be converted to the corresponding enamides under mild conditions in good yields.

Access to β-keto esters by palladium-catalyzed carbonylative coupling of aryl halides with monoester potassium malonates

New tricks for an old dog: The Pd-catalyzed carbonylative α-arylation of monoethyl potassium malonates with aryl bromides and reactive aryl chlorides provides a simple and direct route to aryl β-ketoesters. Because only stoichiometric amounts of carbon monoxide are employed, the method is ideal for the introduction of carbon isotopes into more complex structures. Copyright

Rh(II)-carbenoid mediated 2H-azirine ring-expansion as a convenient route to non-fused photo- and thermochromic 2H-1,4-oxazines

The Rh2(OAc)4-catalyzed domino reaction of 2H-azirines with 2-acyl-2-diazoacetates provides a unique synthetic approach to non-fused 2H-1,4-oxazines. The reaction proceeds via sequential formation of a rhodium carbenoid, an azirinium

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