863118-41-6

Basic information

• Product Name: 6-TRIFLUOROMETHYL-BENZO[B]THIOPHENE-2-CARBOXYLIC ACID METHYL ESTER
• Synonyms: Methyl 6-(trifluoromethyl)-1-benzothiophene-2-carboxylate; Methyl 6-(trifluoromethyl)benzo[b]thiophene-2-carboxylate; Methyl-6-(trifluormethyl)-1-benzothiophen-2-carboxylat
• CAS NO: 863118-41-6
• Molecular Formula: C11H7F3O2S
• Molecular Weight: 260.24
• Mol File: 863118-41-6.mol
• Article Data: 7

Chemical Properties

• Melting Point: 105-107°
• Boiling Point: 312.4°C at 760 mmHg
• Flash Point: 142.7°C
• Appearance: /
• Density: 1.41g/cm³
• Vapor Pressure: 0.00053mmHg at 25°C
• Refractive Index: 1.555
• CAS DataBase Reference: 6-TRIFLUOROMETHYL-BENZO[B]THIOPHENE-2-CARBOXYLIC ACID METHYL ESTER(CAS DataBase Reference)
• NIST Chemistry Reference: 6-TRIFLUOROMETHYL-BENZO[B]THIOPHENE-2-CARBOXYLIC ACID METHYL ESTER(863118-41-6)
• EPA Substance Registry System: 6-TRIFLUOROMETHYL-BENZO[B]THIOPHENE-2-CARBOXYLIC ACID METHYL ESTER(863118-41-6)

Safety Data

• HazardClass: IRRITANT
• Hazardous Substances Data: 863118-41-6(Hazardous Substances Data)

Usage

General Description

6-Trifluoromethyl-benzo[b]thiophene-2-carboxylic acid methyl ester is a chemical compound with the molecular formula C11H7F3O2S. It is an ester derivative of benzo[b]thiophene-2-carboxylic acid, with a trifluoromethyl group attached to the aromatic ring. 6-TRIFLUOROMETHYL-BENZO[B]THIOPHENE-2-CARBOXYLIC ACID METHYL ESTER is commonly used in the synthesis of pharmaceuticals and agrochemicals due to its versatile reactivity and potential biological activity. It is often employed as a building block in organic synthesis, and its trifluoromethyl group can impart unique properties to the molecules it is incorporated into. 6-TRIFLUOROMETHYL-BENZO[B]THIOPHENE-2-CARBOXYLIC ACID METHYL ESTER is also a valuable tool in the development of new drugs and materials with enhanced properties.

InChI:InChI=1/C11H7F3O2S/c1-16-10(15)9-4-6-2-3-7(11(12,13)14)5-8(6)17-9/h2-5H,1H3

Upstream product

• 2365-48-2 Methyl thioglycolate 
• 89763-93-9 2-Fluoro-4-(trifluoromethyl)benzaldehyde 

Relevant articles and documents

Design, synthesis, and biological activity evaluation of 2-(benzo[b]thiophen-2-yl)-4-phenyl-4,5-dihydrooxazole derivatives as broad-spectrum antifungal agents

To discover antifungal compounds with broad-spectrum and stable metabolism, a series of 2-(benzo[b]thiophen-2-yl)-4-phenyl-4,5-dihydrooxazole derivatives was designed and synthesized. Compounds A30-A34 exhibited excellent broad-spectrum antifungal activity against Candida albicans with MIC values in the range of 0.03–0.5 μg/mL, and against Cryptococcus neoformans and Aspergillus fumigatus with MIC values in the range of 0.25–2 μg/mL. In addition, compounds A31 and A33 showed high metabolic stability in human liver microsomes in vitro, with the half-life of 80.5 min and 69.4 min, respectively. Moreover, compounds A31 and A33 showed weak or almost no inhibitory effect on the CYP3A4 and CYP2D6. The pharmacokinetic evaluation in SD rats showed that compound A31 had suitable pharmacokinetic properties and was worthy of further study.

AGRICHEMICAL COMPOSITION AND METHOD OF PROMOTING GROWTH OF PLANT

An agrichemical composition comprising a compound represented by the formula (1) and at least one fungicidally active compound selected from Group (A). Group (A): metalaxyl, metalaxyl-M, benalaxyl, benalaxyl-M, pyraclostrobin, trifloxystrobin, azoxystrobin, dimoxystrobin, fluoxastrobin, kresoxim methyl, picoxystrobin, metconazole, ipconazole, tebuconazole, difenoconazole, epoxiconazole, fluquinconazole, triticonazole, triadimenol, prothioconazole, propioconazole, prochloraz, penconazole, flusilazole, diniconazole, bromuconazole, cyproconazole, triflumizole, tetraconazole, myclobutanil, bitertanol, imazalil and the like.

METHOD FOR PROMOTING PLANT GROWTH

Disclosed is a method for promoting the growth of a plant, comprising treating the plant with an effective amount of a compound represented by the following formula (1):, wherein any one of R1, R2, R3 and R4 represents a trifluoromethyl group, and the others represent a hydrogen atom, or an agriculturally acceptable salt thereof.