92636-38-9

Basic information

• Product Name: 1-[4-(TRIFLUOROMETHYL)PHENYL]-1H-PYRROLE
• Synonyms: 1-[4-(TRIFLUOROMETHYL)PHENYL]PYRROLE;1-[4-(TRIFLUOROMETHYL)PHENYL]-1H-PYRROLE
• CAS NO: 92636-38-9
• Molecular Formula: C₁₁H₈F₃N
• Molecular Weight: 211.18
• Mol File: 92636-38-9.mol
• Article Data: 14

Chemical Properties

• Melting Point: 107-111
• Boiling Point: 152/53mm
• Flash Point: 98.9°C
• Appearance: /
• Density: 1.18g/cm³
• Vapor Pressure: 0.0605mmHg at 25°C
• Refractive Index: 1.5
• CAS DataBase Reference: 1-[4-(TRIFLUOROMETHYL)PHENYL]-1H-PYRROLE(CAS DataBase Reference)
• NIST Chemistry Reference: 1-[4-(TRIFLUOROMETHYL)PHENYL]-1H-PYRROLE(92636-38-9)
• EPA Substance Registry System: 1-[4-(TRIFLUOROMETHYL)PHENYL]-1H-PYRROLE(92636-38-9)

Safety Data

• Hazard Codes: Xi
• Hazardous Substances Data: 92636-38-9(Hazardous Substances Data)

Usage

General Description

1-[4-(Trifluoromethyl)phenyl]-1H-pyrrole is a chemical compound with the molecular formula C11H8F3N. It is a pyrrole derivative with a trifluoromethyl group attached to the phenyl ring. 1-[4-(TRIFLUOROMETHYL)PHENYL]-1H-PYRROLE is commonly used in organic synthesis and pharmaceutical research as a building block for the synthesis of various biologically active molecules. The trifluoromethyl group can impart unique physicochemical properties to the compound, making it valuable for drug discovery and development. Additionally, the presence of the pyrrole moiety gives this compound some potential for use as a ligand in coordination chemistry and for the development of metal-organic frameworks.

InChI:InChI=1/C11H8F3N/c12-11(13,14)9-3-5-10(6-4-9)15-7-1-2-8-15/h1-8H

Upstream product

• 6117-80-2 1,4-butenediol 
• 402-54-0 p-nitrobenzotrifluoride 
• 109-97-7 pyrrole 
• 402-43-7 p-trifluoromethylphenyl bromide 
• 455-13-0 4-Iodobenzotrifluoride 
• 2923-16-2 potassium trifluoroacetate 
• 92636-36-7 1-(4-iodophenyl)pyrrole 
• 696-59-3 cis,trans-2,5-dimethoxytetrahydrofuran 
• 455-14-1 4-trifluoromethylphenylamine 
• 5044-38-2 1-(4-chlorophenyl)-1H-pyrrole 
• 120120-26-5 (trifluoromethyl)triethylsilane 
• 98-56-6 4-chlorobenzotrifluoride 

Downstream Products

• 113845-68-4 1-(4(-trifluoromethyl)phenyl)pyrrolidine 

Relevant articles and documents

Utilization of caffeine carbon supported cobalt catalyst in the tandem synthesis of pyrroles from nitroarenes and alkenyl diols

Employing bio-waste caffeine carbon-supported heterogeneous cobalt catalyst, synthesis of various substituted pyrrole derivatives is reported. In this methodology, pyrroles were synthesized through coupling between nitroarenes and alkenyl diols in a tandem manner. Among all the heterogeneous catalysts Co(OAc)2-CC-800 displayed the highest catalytic activity. Preparative scale synthesis of pyrroles and synthesis of anti-tubercular agent 5-(4-(1H-pyrrol-1-yl)phenyl)-1,3,4-oxadiazole-2-thiol revealed the practical applicability of this protocol. Several kinetic experiments and Hammett studies were conducted to understand the probable mechanism and electronic effects on this transformation.

Nickel-catalyzed decarbonylation of: N -acylated N-heteroarenes

Nickel-catalyzed decarbonylation of N-acylated N-heteroarenes is developed. This method can be used to produce a variety of N-aryl heteroarenes, including pyrroles, indoles, carbazoles and phenoxazines, using benzoic acid derivatives as arylating reagents. Arylnickelamide intermediates that are relevant to the catalytic reaction were characterized by X-ray crystallography. When N-acylated benzimidazoles are used as substrates, decarbonylation accompanied 1,2-migration to form 2-arylated benzimidazoles.

Copper(I) Oxide/N,N′-Bis[(2-furyl)methyl]oxalamide-Catalyzed Coupling of (Hetero)aryl Halides and Nitrogen Heterocycles at Low Catalytic Loading

An easily prepared oxalic diamide is a powerful ligand for the copper-catalyzed coupling of aryl halides with nitrogen heterocycles. Only 1–2 mol% each of copper(I) oxide and N,N′-bis[(2-furyl)methyl]oxalamide (BFMO) are needed to form N-arylation products under mild conditions. More than 10 different types of nitrogen heterocycles are compatible with these conditions, thereby giving the corresponding N-arylation products. (Figure presented.).