6975-13-9

Basic information

• Product Name: Nsc22077
• Synonyms: Nsc22077;Ethyl 3-methyl-4,4,4-trifluorobutanoate 97%;Ethyl 4,4,4-trifluoro-3-methylbutanoate;Ethyl3-methyl-4,4,4-trifluorobutanoate97%
• CAS NO: 6975-13-9
• Molecular Formula: C₇H₁₁F₃O₂
• Molecular Weight: 184.1562496
• Mol File: 6975-13-9.mol
• Article Data: 4

Chemical Properties

• Boiling Point: 119.9°Cat760mmHg
• Flash Point: 0.1°C
• Appearance: /
• Density: 1.12g/cm³
• Vapor Pressure: 15.6mmHg at 25°C
• Refractive Index: 1.364
• CAS DataBase Reference: Nsc22077(CAS DataBase Reference)
• NIST Chemistry Reference: Nsc22077(6975-13-9)
• EPA Substance Registry System: Nsc22077(6975-13-9)

Safety Data

• Hazardous Substances Data: 6975-13-9(Hazardous Substances Data)

Usage

General Description

NSC 22077, also known as 4-(1,3,4-oxadiazol-2-yl)benzene-1,3-diol, is a synthetic chemical compound that has been studied for its potential anti-cancer and anti-inflammatory properties. It is a small molecule inhibitor of the protein kinase AKT, which plays a key role in cell growth, survival, and metabolism. NSC 22077 has been shown to inhibit the growth and survival of cancer cells in various preclinical studies, making it a potential candidate for cancer therapy. Additionally, it has also demonstrated anti-inflammatory effects by reducing the production of pro-inflammatory cytokines. Further research is needed to fully elucidate its therapeutic potential and possible side effects.

InChI:InChI=1/C7H11F3O2/c1-3-12-6(11)4-5(2)7(8,9)10/h5H,3-4H2,1-2H3/t5-/m0/s1

Upstream product

• 691-77-0 (E)-3-trifluoromethyl-2-butenoic acid ethyl ester 
• 93404-33-2 3-trifluoromethyl-2-butenoic acid 
• 867-13-0 diethoxyphosphoryl-acetic acid ethyl ester 
• 421-50-1 1,1,1-trifluoro-2-propanone 
• 623-70-1 ethyl (E)-crotonate 
• 76-05-1 trifluoroacetic acid 
• 64-17-5 ethanol 
• 348-75-4 (-)-3-trifluoromethylbutanoic acid 

Downstream Products

• 1192040-53-1 Ethyl 4,4,4-trifluoro-3-methyl-2-{4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]phenyl}-butanoate 
• 1192039-83-0 ethyl 2-[4-(bromomethyl)phenyl]-4,4,4-trifluoro-3-methylbutanoate 
• 1192039-73-8 ethyl 4,4,4-trifluoro-3-methyl-2-(4-methylphenyl)butanoate 
• 794568-87-9 rac-1-(2-methylphenyl)-6-(3,3,3-trifluoro-2-methylpropyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one 
• 95853-76-2 (2S,4R)-(+)-2-<(4S,5S)-(2,2-Dimethyl-4-phenyl-1,3-dioxan-5-yl)amino>-5,5,5-trifluor-4-methylvaleronitril 
• 95911-01-6 (2R,4R)-2-<(4S,5S)-(2,2-Dimethyl-4-phenyl-1,3-dioxan-5-yl)amino>-5,5,5-trifluor-4-methylvaleronitril 
• 95853-77-3 (2S,4R)-(+)-5,5,5-Trifluor-2-<(1S,2S)-(2-hydroxy-1-hydroxymethyl-2-phenylethyl)amino>-4-methylvaleriansaeure 
• 95853-69-3 (+/-)-4,4,4-Trifluor-3-methyl-1-butanal 
• 95853-72-8 (R)-(+)-4,4,4-Trifluor-3-methylbutyl-(p-toluolsulfonat) 
• 339-62-8 (+/-)-4,4,4-Trifluor-3-methyl-1-butanol 
• 862646-44-4 N-[4-chloro-2-(4,4,4-trifluoro-3-methylbutyryl)-phenyl]-2,2-dimethylpropionamide 

Relevant articles and documents

Diastereoselectivity of enolate anion protonation. H/D exchange of β-substituted ethyl butanoates in ethanol-d

The stereochemistry of base-catalyzed H/D exchange on 13 β-substituted ethyl butanoates in ethanol-d has been studied in order to analyze the steric and electronic factors which control the diastereoselectivity of electrophilic attack on enolate anions. E

ASYMMETRICAL REDUCTION OF PERFLUOROALKYLATED KETONES, KETOESTERS AND VINYL COMPOUNDS WITH BAKER'S YEAST

Reduction of perfluoroalkylated ketones, ketoesters and vinyl compounds with baker's yeast was studied.The ketones and β-ketoesters were asymmetrically reduced to give optically active perfluoroalkylated carbinols and hydroxyesters, while the vinyl compounds were reduced to perfluoroalkylated alkanes.