6028-89-3

Basic information

• Product Name: 3-(2-THIENYL)-1-(P-TOLYL)-PROP-2-EN-1-ONE
• Synonyms: 1-(4-METHYLPHENYL)-3-(2-THIENYL)-2-PROPEN-1-ONE;1-(4-METHYLPHENYL)-3-(2-THIENYL)PROP-2-EN-1-ONE;3-(2-THIENYL)-1-(P-TOLYL)-PROP-2-EN-1-ONE;(2E)-1-(4-Methylphenyl)-3-(2-thienyl)-2-propen-1-one;3-(2-THIENYL)-1-(P-TOLYL)-2-PROPEN-1-ONE, 98%;1-(4-METHYLPHENYL)-3-(THIEN-2-YL)PROP-2-EN-1-ONE;(E)-3-(thiophen-2-yl)-1-(p-tolyl)prop-2-en-1-one;(2E)-1-(4-methylphenyl)-3-(thiophen-2-yl)prop-2-en-1-one
• CAS NO: 6028-89-3
• Molecular Formula: C₁₄H₁₂OS
• Molecular Weight: 228.31
• Mol File: 6028-89-3.mol
• Article Data: 9

Chemical Properties

• Melting Point: 75 °C
• Boiling Point: 381.5 °C at 760 mmHg
• Flash Point: 184.5 °C
• Appearance: /
• Density: 1.167 g/cm³
• Vapor Pressure: 5.04E-06mmHg at 25°C
• Refractive Index: 1.638
• CAS DataBase Reference: 3-(2-THIENYL)-1-(P-TOLYL)-PROP-2-EN-1-ONE(CAS DataBase Reference)
• NIST Chemistry Reference: 3-(2-THIENYL)-1-(P-TOLYL)-PROP-2-EN-1-ONE(6028-89-3)
• EPA Substance Registry System: 3-(2-THIENYL)-1-(P-TOLYL)-PROP-2-EN-1-ONE(6028-89-3)

Safety Data

• Hazardous Substances Data: 6028-89-3(Hazardous Substances Data)

Usage

General Description

3-(2-Thienyl)-1-(p-tolyl)-prop-2-en-1-one is a chemical compound with the molecular formula C16H14OS. It is a yellow crystalline powder with a molecular weight of 270.35 g/mol. 3-(2-THIENYL)-1-(P-TOLYL)-PROP-2-EN-1-ONE is also known as thienyl tolpropenone and is used in organic synthesis and pharmaceutical research. It is known for its potential biological activities, including antimicrobial, anti-inflammatory, and anticancer properties. Additionally, it is used as a building block in the synthesis of various pharmaceuticals and biologically active molecules.

InChI:InChI=1/C14H12OS/c1-11-4-6-12(7-5-11)14(15)9-8-13-3-2-10-16-13/h2-10H,1H3/b9-8+

Upstream product

• 98-03-3 thiophene-2-carbaldehyde 
• 122-00-9 para-methylacetophenone 

Downstream Products

• 102159-04-6 2-oxo-6-[2]thienyl-4-p-tolyl-cyclohex-3-enecarboxylic acid ethyl ester 
• 127844-84-2 3-amino-4'-methyl-5-thiophen-2-yl-biphenyl-2,4-dicarbonitrile 
• 133726-93-9 2,6?diphenyl?4?(thiophen?2?yl)pyridine 
• 1346008-76-1 (E)-3-(5-(pyridin-3-yl)-thiophen-2-yl)-1-p-tolylpropenone 
• 1346008-74-9 (E)-3-[5-(3-oxo-3-p-tolylpropenyl)-thiophen-2-yl]benzonitrile 
• 1346008-75-0 (E)-2-[5-(3-oxo-3-p-tolylpropenyl)-thiophen-2-yl]benzonitrile 
• 1346008-73-8 (E)-4-[5-(3-oxo-3-p-tolylpropenyl)-thiophen-2-yl]benzaldehyde 
• 1380402-72-1 (3R,4R)-3-phenyl-4-(thiophen-2-yl)-6-(p-tolyl)-1-tosyl-3,4-dihydropyridin-2(1H)-one 
• 1380402-86-7 4-methyl-N-((E)-3-(thiophen-2-yl)-1-(p-tolyl)allylidene)benzenesulfonamide 
• 1019177-62-8 C₁₅H₁₅N₃S₂ 
• 929468-09-7 4-phenyl-2-(5-(thiophen-2-yl)-3-(p-tolyl)-4,5-dihydro-1H-pyrazol-1-yl)thiazole 
• 929408-94-6 4-(4-methoxyphenyl)-2-(5-(thiophen-2-yl)-3-(p-tolyl)-4,5-dihydro-1H-pyrazol-1-yl)thiazole 
• 1386394-37-1 2-(3-(4-methylphenyl)-5-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl)thiazol-4(5H)-one 

Relevant articles and documents

Studies of NMR Chemical Shifts of Chalcone Derivatives of Five-membered Monoheterocycles and Determination of Aromaticity Indices

A series of the chalcone derivatives of the five-membered monoheterocyclic compounds, (E)-1-aryl-3-heteroarylpropen-1-ones, were prepared by aldol condensation of the corresponding aldehydes of thiophene, pyrrole, and furan with m- and p-substituted acetophenones. Similar condensation of the acetyl compounds of the heterocycles with m- and p-substituted benzaldehydes gave another series of the chalcone derivatives, (E)-1-heteroaryl-3-arylpropen-1-ones. The 13C chemical shift values (δC) of the chalcone derivatives were determined in order to find if they correlated with the Hammett σ values. A good correlation, especially for the β-C for both series, was found for the 13C chemical shift values (δC) of the chalcone derivatives with the Hammett σ values. The chemical shift values of the β-C of the heterocyclic compounds were plotted against those of the benzene derivatives. The resulting slopes were found to be close to the values of the aromaticity indices.

Synthesis, biological evaluation and 3D-QSAR study of novel 4,5-dihydro-1H-pyrazole thiazole derivatives as BRAFV600E inhibitors

Many reports implied that the BRAF serine/threonine kinase was mutated in various types of human tumors, which were related with cell growth, survival and differentiation. To provide new therapeutic opportunities, a series of novel 4,5-dihydro-1H-pyrazole

Discovery and modification of sulfur-containing heterocyclic pyrazoline derivatives as potential novel class of β-ketoacyl-acyl carrier protein synthase III (FabH) inhibitors

A series of sulfur-containing heterocyclic pyrazoline derivatives (C1-C18; D1-D9) have been synthesized and purified (all are new except one) to screen for FabH inhibitory activity. Compound C14 showed the most potent biological activity against Escherich