101498-88-8

Basic information

• Product Name: ETHYL 3-(4-TERT-BUTYLPHENYL)-3-OXOPROPANOATE
• Synonyms: 3-(4-TERT-BUTYL-PHENYL)-3-OXO-PROPIONIC ACID ETHYL ESTER;ETHYL 3-(4-TERT-BUTYLPHENYL)-3-OXOPROPANOATE;ETHYL (4-TERT-BUTYLBENZOYL)ACETATE
• CAS NO: 101498-88-8
• Molecular Formula: C₁₅H₂₀O₃
• Molecular Weight: 248.32
• Mol File: 101498-88-8.mol

Chemical Properties

• Boiling Point: 335.1°C at 760 mmHg
• Flash Point: 143.8°C
• Appearance: /
• Density: 1.031g/cm³
• Vapor Pressure: 0.000122mmHg at 25°C
• Refractive Index: 1.496
• PKA: 10.15±0.25(Predicted)
• CAS DataBase Reference: ETHYL 3-(4-TERT-BUTYLPHENYL)-3-OXOPROPANOATE(CAS DataBase Reference)
• NIST Chemistry Reference: ETHYL 3-(4-TERT-BUTYLPHENYL)-3-OXOPROPANOATE(101498-88-8)
• EPA Substance Registry System: ETHYL 3-(4-TERT-BUTYLPHENYL)-3-OXOPROPANOATE(101498-88-8)

Safety Data

• Hazardous Substances Data: 101498-88-8(Hazardous Substances Data)

Usage

Uses

Used in Organic Synthesis:
ETHYL 3-(4-TERT-BUTYLPHENYL)-3-OXOPROPANOATE is used as an intermediate in the synthesis of various organic compounds for different applications. Its unique structure allows it to be a valuable building block in the creation of complex molecules, contributing to the development of new products in the chemical industry.

InChI:InChI=1/C15H20O3/c1-5-18-14(17)10-13(16)11-6-8-12(9-7-11)15(2,3)4/h6-9H,5,10H2,1-4H3

Upstream product

• 6148-64-7 ethyl potassium malonate 
• 98-73-7 4-(1,1-dimethylethyl)benzoic acid 
• 141-97-9 ethyl acetoacetate 
• 1710-98-1 p-tert-butyl benzoyl chloride 
• 943-27-1 4'-t-butylacetophenone 
• 15226-74-1 dicobalt octacarbonyl 
• 3972-65-4 1-bromo-4-tert-butylbenzene 
• 35779-04-5 1-tert-butyl-4-iodobenzene 
• 105-58-8 Diethyl carbonate 
• 141-78-6 ethyl acetate 
• 95-92-1 oxalic acid diethyl ester 
• 679843-87-9 1-(4-tert-butylphenyl)-3,3-bis(morpholino)prop-2-en-1-one 

Downstream Products

• 211045-68-0 6-tert-butyl-2-(p-tert-butylphenyl)-4H-1-benzothiopyran-4-one 
• 760959-54-4 1,3-di(p-tert-butylphenyl)pyrazolin-5-one 
• 760959-55-5 3-(p-tert-butylphenyl)-1-(p-methylphenyl)pyrazolin-5-one 
• 760959-61-3 3-(p-tert-butylphenyl)-5-chloro-4-formyl-1-(p-methylphenyl)pyrazole 
• 760959-59-9 1,3-di(4-tert-butylphenyl)-5-chloro-4-formylpyrazole 

Relevant articles and documents

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A direct method for the synthesis of β-ketoesters from aryl halides (iodide, bromide) has been described by using cobalt carbonyl as carbon monoxide source in microwave irradiation. Using this protocol, a wide variety of substituted aryl halides has been successfully converted to corresponding β-ketoesters.

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