2712-68-7

Basic information

• Product Name: 1-(3,4-DICHLORO-PHENYL)-4,4,4-TRIFLUORO-BUTANE-1,3-DIONE
• Synonyms: AKOS B007352;1-(3,4-DICHLORO-PHENYL)-4,4,4-TRIFLUORO-BUTANE-1,3-DIONE;ART-CHEM-BB B007352;1-(3,4-Dichloro-phenyl)-4,4,4-trifluoro-butane-;1-(3,4-Dichlorobenzoyl)-3,3,3-trifluoroacetone
• CAS NO: 2712-68-7
• Molecular Formula: C₁₀H₅Cl₂F₃O₂
• Molecular Weight: 285.05
• Mol File: 2712-68-7.mol
• Article Data: 6

Chemical Properties

• Boiling Point: 338.1±42.0 °C(Predicted)
• Appearance: /
• Density: 1.489±0.06 g/cm3(Predicted)
• PKA: 4.80±0.25(Predicted)
• CAS DataBase Reference: 1-(3,4-DICHLORO-PHENYL)-4,4,4-TRIFLUORO-BUTANE-1,3-DIONE(CAS DataBase Reference)
• NIST Chemistry Reference: 1-(3,4-DICHLORO-PHENYL)-4,4,4-TRIFLUORO-BUTANE-1,3-DIONE(2712-68-7)
• EPA Substance Registry System: 1-(3,4-DICHLORO-PHENYL)-4,4,4-TRIFLUORO-BUTANE-1,3-DIONE(2712-68-7)

Safety Data

• Hazardous Substances Data: 2712-68-7(Hazardous Substances Data)

Usage

General Description

1-(3,4-Dichloro-phenyl)-4,4,4-trifluoro-butane-1,3-dione is a chemical compound that is commonly used as a building block in the synthesis of various pharmaceuticals, agricultural products, and industrial chemicals. It is a highly stable and non-reactive compound that is often used as an intermediate in the production of complex organic molecules. This chemical is known for its unique chemical properties, including its ability to form strong bonds with other compounds and its resistance to degradation under various environmental conditions. Additionally, it is frequently used as a reference standard in analytical chemistry and as a reagent in laboratory experiments. Overall, 1-(3,4-Dichloro-phenyl)-4,4,4-trifluoro-butane-1,3-dione is an important and versatile chemical compound with a wide range of applications in the pharmaceutical, agricultural, and chemical industries.

Upstream product

• 383-63-1 ethyl trifluoroacetate, 
• 2642-63-9 3',4'-dichloroacetophenone 

Downstream Products

• 1581726-15-9 C₁₉H₁₄Cl₂F₃N₃O₂S 
• 1014623-04-1 C₁₃H₅Cl₂F₃N₂S 
• 329212-64-8 5-(3,4-dichloro-phenyl)-7-trifluoromethyl-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid 

Relevant articles and documents

Synthesis, fungicidal activity and mode of action of 4-phenyl-6-trifluoromethyl-2-aminopyrimidines against Botrytis cinerea

Anilinopyrimidines are the main chemical agents for management of Botrytis cinerea. However, the drug resistance in fungi against this kind of compounds is very serious. To explore new potential fungicides against B. cinerea, a series of 4-phenyl-6-trifluoromethyl-2-amino-pyrimidine compounds (compounds III-1 to III-22) were synthesized, and their structures were confirmed by 1H-NMR, IR and MS. Most of these compounds possessed excellent fungicidal activity. The compounds III-3 and III-13 showed higher fungicidal activity than the positive control pyrimethanil on fructose gelatin agar (FGA), and compound III-3 on potato dextrose agar (PDA) indicated high activity compared to the positive control cyprodinil. In vivo greenhouse results indicated that the activity of compounds III-3, III-8, and III-11 was significantly higher than that of the fungicide pyrimethanil. Scanning electron micrography (SEM) and transmission electron micrography (TEM) were applied to illustrate the mechanism of title compounds against B. cinerea. The title compounds, especially those containing a fluorine atom at the ortho-position on the benzene ring, could maintain the antifungal activity against B. cinerea, but their mechanism of action is different from that of cyprodinil. The present study lays a good foundation for us to find more efficient reagents against B. cinerea.

Discovery and structure-activity relationships study of novel thieno[2,3-b]pyridine analogues as hepatitis C virus inhibitors

Current treatment for hepatitis C is barely satisfactory, there is an urgent need to develop novel agents for combating hepatitis C virus infection. This study discovered a new class of thieno[2,3-b]pyridine derivatives as HCV inhibitors. First, a hit compound characterized by a thienopyridine core was identified in a cell-based screening of our privileged small molecule library. And then, structure activity relationship study of the hit compound led to the discovery of several potent compounds without obvious cytotoxicity in vitro (12c, EC50 = 3.3 μM, SI >30.3, 12b, EC50 = 3.5 μM, SI >28.6, 10l, EC50 = 3.9 μM, SI >25.6, 12o, EC 50 = 4.5 μM, SI >22.2, respectively). Although the mechanism of them had not been clearly elucidated, our preliminary optimization of this class of compounds had provided us a start point to develop new anti-HCV agents.

New Heterocyclic compounds for therapeutic use

A class of compounds particularly diaryl pyrazole of general formulas 1 and 2 where R and R′ represents alkyl, hydrogen, halogens, haloalkyl, cyano, nitro, formyl, carboxyl, alkoxycarbonyl, carboxyalkyl, alkoxycarbonylalkyl, hydroxyalkyl, alkylthio, alkylsulfinyl, alkylsulphonyl, N- alkylsulfamyl, N-arylsulfamyl, cyanoamido, amino, amidino, N-monoalkylamido, N-monoarylamido, N,N-dialkylamido, N-alkyl-N-arylamido, N, N-dialkylsulfamyl with the alkyl, or alkyl part of each such group containing 1-3 carbon atoms or mixtures thereof optionally their salts when they exist, and preparation thereof. The compounds of the present invention are antiinflammatory, antipyretic, antirheumatic, antiosteoarthritic agents with antibacterial activity. The particular class of compounds is given below (Formula 1 and Formula 2).