20972-36-5

Basic information

• Product Name: 3-(4-METHYLBENZOYL)ACRYLIC ACID
• Synonyms: OTAVA-BB BB7110952593;TRANS-3-(4-METHYLBENZOYL)ACRYLIC ACID;AURORA 23286;(E)-4-(4-METHYLPHENYL)-4-OXO-2-BUTENOIC ACID;(E)-4-OXO-4-P-TOLYLBUT-2-ENOIC ACID;AKOS BBS-00002156;(2E)-4-(4-METHYLPHENYL)-4-OXOBUT-2-ENOIC ACID;3-(4-METHYLBENZOYL)ACRYLIC ACID
• CAS NO: 20972-36-5
• Molecular Formula: C₁₁H₁₀O₃
• Molecular Weight: 190.2
• Product Categories: Aromatic Cinnamic Acids, Esters and Derivatives
• Mol File: 20972-36-5.mol
• Article Data: 19

Chemical Properties

• Melting Point: 138-140 °C(lit.)
• Boiling Point: 361.8 °C at 760 mmHg
• Flash Point: 186.8 °C
• Appearance: /
• Density: 1.2 g/cm³
• Vapor Pressure: 7.24E-06mmHg at 25°C
• Refractive Index: 1.569
• PKA: 3.22±0.10(Predicted)
• BRN: 2691231
• CAS DataBase Reference: 3-(4-METHYLBENZOYL)ACRYLIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: 3-(4-METHYLBENZOYL)ACRYLIC ACID(20972-36-5)
• EPA Substance Registry System: 3-(4-METHYLBENZOYL)ACRYLIC ACID(20972-36-5)

Safety Data

• Hazard Codes: Xi,Xn
• Statements: 36/37/38-22
• Safety Statements: 26-37/39
• WGK Germany: 3
• HazardClass: IRRITANT
• Hazardous Substances Data: 20972-36-5(Hazardous Substances Data)

Usage

General Description

3-(4-Methylbenzoyl)acrylic acid is a chemical compound with the molecular formula C11H10O3. It is a derivative of acrylic acid, containing a 4-methylbenzoyl group. 3-(4-METHYLBENZOYL)ACRYLIC ACID is used in the synthesis of various pharmaceuticals and organic materials. It has potential applications in the field of organic chemistry and materials science due to its unique structure and reactivity. 3-(4-Methylbenzoyl)acrylic acid may also have uses in the development of new drugs and materials with specific properties. Overall, this compound has potential for various applications in the field of organic chemistry and materials science.

InChI:InChI=1/C11H10O3/c1-8-2-4-9(5-3-8)10(12)6-7-11(13)14/h2-7H,1H3,(H,13,14)/b7-6+

Upstream product

• 108-31-6 maleic anhydride 
• 108-88-3 toluene 
• 18103-98-5 3-dimethylamino-1-(4-methyl-phenyl)-2-propen-1-one 
• 122-00-9 para-methylacetophenone 
• 298-12-4 Glyoxilic acid 
• 6000-59-5 glyoxalic acid monohydrate 
• 619-41-0 4-(bromoacetyl)toluene 
• 2689-61-4 (2-oxo-2-p-tolylethyl)triphenylphosphonium bromide 
• 124658-44-2 C₁₃H₁₄O₃ 
• 1777-53-3 1-(p-tolyl)-2-(triphenylphosphoranylidene)ethanone 

Downstream Products

• 122-00-9 para-methylacetophenone 
• 847410-27-9 2,3-dibromo-4-oxo-4-p-tolyl-butyric acid 
• 35947-35-4 4-oxo-2,4-di-p-tolyl-butyric acid 
• 124414-24-0 8-Chloro-4-p-tolyl-2,3-dihydro-benzo[b][1,4]thiazepine-2-carboxylic acid 
• 124414-27-3 8-Ethoxy-4-p-tolyl-2,3-dihydro-benzo[b][1,4]thiazepine-2-carboxylic acid 
• 32149-28-3 Methyl 4-keto-4-(4'-methylphenyl)but-2-enoate 
• 124658-44-2 ethyl (2E)-4-(4-methylphenyl)-4-oxobut-2-enoate 
• 144898-78-2 4-Oxo-3-(4-oxo-3-phenyl-3,4-dihydro-quinazolin-2-ylsulfanyl)-4-p-tolyl-butyric acid 
• 129887-35-0 γ-(3,4-dihydroxyphenyl)-γ-(4-methylphenyl)-Δ^α,β-butenolide 
• 116274-70-5 4-p-Tolyl-2,3-dihydro-benzo[b][1,4]thiazepine-2-carboxylic acid 
• 155373-13-0 4-(p-toluoyl)-3,4-dihydro-5,6-benzocoumarin 
• 141996-58-9 5-p-Tolyl-2,3-dihydro-furan-2,3-dicarboxylic acid 2-ethyl ester 
• 116274-74-9 8-Methyl-4-p-tolyl-2,3-dihydro-benzo[b][1,4]thiazepine-2-carboxylic acid 
• 124414-23-9 2-Carboxy-2,3-dihydro-4-(p-tolyl)-8-fluoro-1,5-benzothiazepine 

Relevant articles and documents

Molecular diversity in cyclization of Ugi-products leading to the synthesis of 2,5-diketopiperazines: computational study

Abstract: Ugi-adducts were obtained via a one-pot four-component reaction of divergent aldehydes, amines, aroylacrylic acids and isocyanide in methanol. These products were subjected to intramolecular Michael addition in the presence of K2COsu

Microwave-assisted synthesis of 4-oxo-2-butenoic acids by aldol-condensation of glyoxylic acid

4-Oxobutenoic acids are useful as biologically active species and as versatile intermediates for further derivatisation. Currently, routes to their synthesis can be problematic and lack generality. Reaction conditions for the synthesis of 4-oxo-2-butenoic

Metal-free reduction of unsaturated carbonyls, quinones, and pyridinium salts with tetrahydroxydiboron/water

A series of unsaturated carbonyls, quinones, and pyridinium salts have been effectively reduced to the corresponding saturated carbonyls, dihydroxybenzenes, and hydropyridines in moderate to high yields with tetrahydroxydiboron/water as a mild, convenient, and metal-free reduction system. Deuterium-labeling experiments have revealed this protocol to be an exclusive transfer hydrogenation process from water. This journal is