56276-49-4

Basic information

• Product Name: 3-PHENYLAZOACETYLACETONE
• Synonyms: 2,4-Pentanedione, 3-(phenylazo)-;3-(phenylazo)-4-pentanedione;Phenyl-azo-acetylaceton;3-PHENYLAZO-2,4-PENTANEDIONE;3-PHENYLAZOACETYLACETONE;LABOTEST-BB LT00455374;3-Phenylazoacethylacetone;3-(phenylazo)pentane-2,4-dione
• CAS NO: 56276-49-4
• Molecular Formula: C₁₁H₁₂N₂O₂
• Molecular Weight: 204.23
• EINECS: 260-089-9
• Mol File: 56276-49-4.mol
• Article Data: 12

Chemical Properties

• Melting Point: 86-87°C
• Boiling Point: 269.2°Cat760mmHg
• Flash Point: 107.9°C
• Appearance: /
• Density: 1.11g/cm³
• Vapor Pressure: 0.00735mmHg at 25°C
• Refractive Index: 1.546
• PKA: 7.01±0.59(Predicted)
• BRN: 643886
• CAS DataBase Reference: 3-PHENYLAZOACETYLACETONE(CAS DataBase Reference)
• NIST Chemistry Reference: 3-PHENYLAZOACETYLACETONE(56276-49-4)
• EPA Substance Registry System: 3-PHENYLAZOACETYLACETONE(56276-49-4)

Safety Data

• Safety Statements: 22-24/25
• RTECS: SA2450000
• HazardClass: IRRITANT
• Hazardous Substances Data: 56276-49-4(Hazardous Substances Data)

Usage

General Description

3-Phenylazoacetylacetone is a specific type of chemical compound that falls under the category of organic azo compounds. Specifically, its molecular structure contains an azo group (-N=N-), a ketone group (RC(=O)R'), and a phenyl ring structure. Organic azo compounds like 3-Phenylazoacetylacetone are known for their vivid colors and are often used as dyes or pigments. However, data regarding its particular uses, toxicity, and other specific properties are not readily available, suggesting that it may not be widely used or studied. Further research would be necessary to provide a comprehensive understanding of this compound.

InChI:InChI=1/C11H12N2O2/c1-8(14)11(9(2)15)13-12-10-6-4-3-5-7-10/h3-7,11H,1-2H3/b13-12+

Upstream product

• 100-63-0 phenylhydrazine 
• 123-54-6 acetylacetone 
• 62-53-3 aniline 

Downstream Products

• 98077-62-4 (3,5-Dimethyl-4-phenylazo-pyrazol-1-yl)-pyridin-2-yl-methanone 
• 130103-06-9 {1-[4-(3,5-Dimethyl-pyrazol-1-yl)-benzenesulfonyl]-3,5-dimethyl-1H-pyrazol-4-yl}-phenyl-diazene 
• 130103-00-3 C₂₂H₂₄N₆O₃S 
• 89488-77-7 4,6-dimethyl-pyrimidine-2,5-diamine 
• 858497-35-5 4-nitro-benzenesulfonic acid-(2-amino-4,6-dimethyl-pyrimidin-5-ylamide) 
• 5440-23-3 3-(N-acetylamido)pentane-2,4-dione 
• 1309479-23-9 C₁₈H₁₆N₄O₂ 
• 3696-00-2 3,5-dimethyl-4-phenylazo-N-thiocarbomylpyrazole 
• 116317-17-0 4-(coumarin-3-yl)-2-(3,5-dimethyl-4-phenyldiazenyl-pyrazol-1-yl)thiazole 
• 1398415-34-3 1-[3-methyl-2-(phenyldiazenyl)-2H-aziren-2-yl]ethanone 
• 1398415-03-6 C₁₁H₁₃N₃O₂ 
• 1169829-22-4 4-acetyl-2-phenyl-5-methyl-1-vinyl-2,3-dihydro-1H-1,2,3-triazole 
• 1169829-09-7 4-acetyl-2-phenyl-5-methyl-N-(2-hydroxyethyl)-2,3-dihydro-1H-1,2,3-triazole 
• 1239368-69-4 C₂₈H₂₂N₈ 

Relevant articles and documents

Design, synthesis, DFT, docking studies and ADME prediction of some new coumarinyl linked pyrazolylthiazoles: Potential standalone or adjuvant antimicrobial agents

The control of antimicrobial resistance (AMR) seems to have come to a dead end. The major consequences of the use and abuse of antibacterial drugs are the development of resistant strains due to genetic mutability of both pathogenic and nonpathogenic microorganisms. We, herein, report the synthesis, characterization and biological activities of coumarin-thiazole-pyrazole (CTP) molecular hybrids with an effort to explore and overcome the increasing antimicrobial resistance. The compounds were characterized by analyzing their IR, Mass, 1H and13C NMR spectral data and elemental analysis. The in vitro antimicrobial activity of the synthesized compounds was investigated against various pathogenic strains; the results obtained were further explained with the help of DFT and molecular orbital calculations. Compound 1b and 1f displayed good antimicrobial activity and synergistic effects when used with kanamycin and amphotericin B. Furthermore, in vitro cytotoxicity of compounds 1b and 1f were studied against HeLa cells (cervical cancer cell) and Hek-293 cells. The results of molecular docking study were used to better rationalize the action and prediction of the binding modes of these compounds.

Synthesis and QSAR modeling 1-[3-methyl-2-(aryldiazenyl)-2H-aziren-2-yl] ethanones as potential antibacterial agents

The present communication deals with the synthesis of a series of 1-[3-methyl-2-(aryldiazenyl)-2H-aziren-2-yl]ethanones. The compounds were synthesized in excellent yields (70-80 %), and the structures were established on the basis of consistent IR, 1H NMR, and elemental analysis data. The purity has been ascertained by chromatographic resolution using hexane-ethyl acetate (6:4 v/v) as binary eluent. All the compounds have been tested for their antimicrobial activity against a representative panel of bacteria i.e., Bacillus subtilis, Escherichia coli, Pseudomonas diminuta, and Staphylococcus aureus using Chloramphenicol as reference drug. All the synthesized compounds were found to exhibit profound antimicrobial activity.

Pyridazine derivatives and related compounds. 23*. synthesis of 3-substituted pyrazolo[3,4-c] pyridazines and their application as disperse dyes

Acetylacetone and malononitrile were coupled with diazotized arylamines to give arylazoacetylacetones and arylazomalononitriles. When refluxed with 3-hydrazino-4,5-diphenyl-1H-pyrazolo-[3,4-c]pyridazine in the presence of ethanol/HCl, they yielded the corresponding 3-[4-(arylazo)-3,5-dimethylpyrazol- 1-yl]- and 3-[3,5-diamino-4-(arylazo)pyrazol-1-yl]-4,5-diphenyl-1H-pyrazolo[3,4- c]pyridazine dyes. The dyes were applied to polyester and polyamide fabrics, and their spectral and fastness properties were measured.