31602-11-6

Basic information

• Product Name: 4-CHLORO-8-(TRIFLUOROMETHYL)QUINOLINE-3-CARBOXYLIC ETHYL ESTER
• Synonyms: ETHYL 4-CHLORO-8-(TRIFLUOROMETHYL)-3-QUINOLINECARBOXYLATE;4-CHLORO-8-(TRIFLUOROMETHYL)QUINOLINE-3-CARBOXYLIC ETHYL ESTER;4-Chloro-8-(trifluoromethyl)quinoline-3-carboxylic acid ethyl ester;4-chloro-8-(trifluoromethyl)quinoline-3-carboxylic acid;ethyl 4-chloro-8-(trifluoromethyl)quinoline-3-carboxylate
• CAS NO: 31602-11-6
• Molecular Formula: C₁₃H₉ClF₃NO₂
• Molecular Weight: 303.66
• Mol File: 31602-11-6.mol
• Article Data: 6

Chemical Properties

• Boiling Point: 338.7°C at 760 mmHg
• Flash Point: 158.6°C
• Appearance: /
• Density: 1.401g/cm³
• Vapor Pressure: 9.66E-05mmHg at 25°C
• Refractive Index: 1.544
• CAS DataBase Reference: 4-CHLORO-8-(TRIFLUOROMETHYL)QUINOLINE-3-CARBOXYLIC ETHYL ESTER(CAS DataBase Reference)
• NIST Chemistry Reference: 4-CHLORO-8-(TRIFLUOROMETHYL)QUINOLINE-3-CARBOXYLIC ETHYL ESTER(31602-11-6)
• EPA Substance Registry System: 4-CHLORO-8-(TRIFLUOROMETHYL)QUINOLINE-3-CARBOXYLIC ETHYL ESTER(31602-11-6)

Safety Data

• Statements: 36
• Safety Statements: 26
• Hazardous Substances Data: 31602-11-6(Hazardous Substances Data)

Usage

General Description

4-CHLORO-8-(TRIFLUOROMETHYL)QUINOLINE-3-CARBOXYLIC ETHYL ESTER is a chemical compound with the molecular formula C15H10ClF3NO2. It is an ethyl ester derivative of 4-chloro-8-(trifluoromethyl)quinoline-3-carboxylic acid. 4-CHLORO-8-(TRIFLUOROMETHYL)QUINOLINE-3-CARBOXYLIC ETHYL ESTER belongs to the class of quinoline carboxylic acid esters, which are used in the synthesis of pharmaceuticals and agrochemicals. It is a yellowish crystalline solid that is sparingly soluble in water but soluble in common organic solvents. 4-CHLORO-8-(TRIFLUOROMETHYL)QUINOLINE-3-CARBOXYLIC ETHYL ESTER has potential applications in medicinal chemistry and drug discovery due to its diverse biological activities and structural features.

InChI:InChI=1/C13H9ClF3NO2/c1-2-20-12(19)8-6-18-11-7(10(8)14)4-3-5-9(11)13(15,16)17/h3-6H,2H2,1H3

Upstream product

• 87-13-8 diethyl 2-ethoxymethylenemalonate 
• 23779-94-4 2-[(2-trifluoromethylphenylamino)methylene]malonic acid diethyl ester 
• 31601-87-3 3-carbethoxy-8-trifluoromethyl-4-quinolone 
• 88-17-5 2-(trifluoromethyl)benzenamine 
• 23851-84-5 4-hydroxy-8-trifluoromethyl-quinoline-3-carboxylic acid ethyl ester 

Downstream Products

• 31588-79-1 8-(trifluoromethyl)quinoline-3-carboxylic acid 
• 31602-18-3 ethyl 8-(trifluoromethyl)-1,4-dihydroquinoline-3-carboxylate 
• 854765-40-5 phenyl[4-phenyl(8-trifluoromethyl)quinolin-3-yl]methanone 
• 1215325-46-4 ethyl 4((R)-1-(dimethylcarbamoyl)-3-(phenylthio)propan-2-ylamino)-8-(trifluoromethyl)quinoline-3-carboxylate 
• 854771-80-5 C₁₉H₁₄F₃NO₃ 
• 206257-97-8 4-[Benzyl-(4-methoxy-benzenesulfonyl)-amino]-8-trifluoromethyl-quinoline-3-carboxylic acid ethyl ester 
• 854777-89-2 [4-chloro-8-(trifluoromethyl)quinolin-3-yl](phenyl)methanone 
• 206258-02-8 4-[Benzyl-(4-methoxy-benzenesulfonyl)-amino]-8-trifluoromethyl-quinoline-3-carboxylic acid 

Relevant articles and documents

Synthetic method of 8-(trifluoromethyl)quinoline-3-carboxylate

The invention provides a synthetic method of 8-(trifluoromethyl)quinoline-3-carboxylate. The synthetic method comprises the following steps: reacting 2-(trifluoromethyl)aniline serving as a starting raw material to obtain 8-(trifluoromethyl)quinoline-3-ethyl ester carboxylate; lastly, hydrolyzing the 8-(trifluoromethyl)quinoline-3-ethyl ester carboxylate in an alkaline environment to obtain 8-(trifluoromethyl)quinoline-3-carboxylate. According to the synthetic method of the 8-(trifluoromethyl)quinoline-3-carboxylate provided by the invention, a synthetic route taking 2-(trifluoromethyl)anilineas a raw material is provided. The synthetic method has the advantages of simple synthetic route, reasonable process selection, low raw material cost, adoption of simple and readily-available raw materials, convenience in operation and post-treatment, high total yield, no use of any highly-toxic reagent, easiness in amplification, realization of large-scale production and the like.

Design and synthesis of some new quinoline-3-carbohydrazone derivatives as potential antimycobacterial agents

A series of 26 new quinoline derivatives carrying active pharmacophores has been synthesized and evaluated for their in vitro antituberculosis activity against Mycobacterium tuberculosis H37Rv (MTB), Mycobacterium smegmatis (MC2), and Mycobacterium fortuitum following the broth micro dilution assay method. Compounds 13e, 13i, 13k, 14a, 14c, 14i, and 14k exhibited significant minimum inhibition concentrations, when compared with first line drugs isoniazid (INH) and rifampicin (RIF) and could be ideally suited for further modifications to obtain more efficacious compounds in the fight against multi-drug resistant tuberculosis.

Quinolines useful in treating cardiovascular disease

This invention provides compounds of formula I that are useful in the treatment or inhibition of LXR mediated diseases.