570-05-8

Basic information

• Product Name: 2,5-DIMETHYL-1-[4-(TRIFLUOROMETHYL)PHENYL]PYRROLE
• Synonyms: 2,5-DIMETHYL-1-[4-(TRIFLUOROMETHYL)PHENYL]-1H-PYRROLE;2,5-DIMETHYL-1-[4-(TRIFLUOROMETHYL)PHENYL]PYRROLE;2,5-Dimethyl-1-[4-(trifluoromethyl)phenyl]-1H-pyrrole 97%;2,5-Dimethyl-1-[4-(trifluoromethyl)phenyl]-1H-pyrrole97%
• CAS NO: 570-05-8
• Molecular Formula: C₁₃H₁₂F₃N
• Molecular Weight: 239.24
• Mol File: 570-05-8.mol
• Article Data: 9

Chemical Properties

• Melting Point: 70-72°C
• Boiling Point: 282.1°Cat760mmHg
• Flash Point: 124.4°C
• Appearance: /
• Density: 1.15g/cm³
• Vapor Pressure: 0.00584mmHg at 25°C
• Refractive Index: 1.499
• CAS DataBase Reference: 2,5-DIMETHYL-1-[4-(TRIFLUOROMETHYL)PHENYL]PYRROLE(CAS DataBase Reference)
• NIST Chemistry Reference: 2,5-DIMETHYL-1-[4-(TRIFLUOROMETHYL)PHENYL]PYRROLE(570-05-8)
• EPA Substance Registry System: 2,5-DIMETHYL-1-[4-(TRIFLUOROMETHYL)PHENYL]PYRROLE(570-05-8)

Safety Data

• Hazard Codes: Xi
• Statements: 20/21/22-36/37/38
• Safety Statements: 26-36/37/39
• Hazardous Substances Data: 570-05-8(Hazardous Substances Data)

Usage

General Description

2,5-Dimethyl-1-[4-(Trifluoromethyl)phenyl]pyrrole is a chemical compound with a complex structure that involves both pyrrole and phenyl rings. The compound includes different atomic groups and elements such as hydrogen, carbon, nitrogen, and fluorine, which allows for diverse chemical behavior. The trifluoromethyl group (CF3) attached to the phenyl ring is a strong electron-withdrawing group, which could influence the reactivity of this compound. Unfortunately, specific details regarding the physical and chemical properties, uses, or potential hazards of this particular compound are not readily available in common databases, suggesting that it might not be widely used or studied. More research would be needed to provide a comprehensive view of this compound and its potential applications or implications.

InChI:InChI=1/C13H12F3N/c1-9-3-4-10(2)17(9)12-7-5-11(6-8-12)13(14,15)16/h3-8H,1-2H3

Upstream product

• 110-13-4 2,5-hexanedione 
• 540-37-4 p-aminoiodobenzene 
• 2923-16-2 potassium trifluoroacetate 
• 288608-09-3 1-(2,5-dimethyl-1H-pyrrol-1-yl)-4-iodobenzene 
• 455-14-1 4-trifluoromethylphenylamine 

Downstream Products

• 455-14-1 4-trifluoromethylphenylamine 
• 256529-25-6 2,5-dimethyl-1-(4-(trifluoromethyl)phenyl)-1H-pyrrole-3-carbaldehyde 
• 1428183-46-3 C₂₂H₂₁F₃N₂O₃ 

Relevant articles and documents

A New FXR Ligand Chemotype with Agonist/Antagonist Switch

Therapeutic modulation of the bile acid-sensing transcription factor farnesoid X receptor (FXR) is an appealing strategy to counteract hepatic and metabolic diseases. Despite the availability of several highly potent FXR agonists structural diversity of FXR modulators is limited, and new ligand scaffolds are needed. Here we report structure-activity relationship elucidation of a new FXR modulator chemotype whose activity can be tuned between agonism and antagonism by two minor structural modifications. Starting from a weak FXR/PPAR agonist, we have developed selective FXR activators and antagonists with nanomolar to low-micromolar potencies and binding affinities. The new FXR ligand chemotype modulates the FXR activity in the native cellular setting, is endowed with favorable metabolic stability, and lacks cytotoxicity. It valuably expands the collection of FXR modulators as a new scaffold for FXR-targeted drug discovery.

Synthesis, structure and in vitro anti-trypanosomal activity of non-toxic arylpyrrole-based chalcone derivatives

With an intention of identifying chalcone derivatives exhibiting anti-protozoal activity, a cohort of relatively unexplored arylpyrrole-based chalcone derivatives were synthesized in moderate to good yields. The resultant compounds were evaluated in vitro for their potential activity against a cultured Trypanosoma brucei brucei 427 strain. Several compounds displayed mostly modest in vitro anti-trypanosomal activity with compounds 10e and 10h emerging as active candidates with IC50 values of 4.09 and 5.11 μM, respectively. More importantly, a concomitant assessment of their activity against a human cervix adenocarcinoma (HeLa) cell line revealed that these compounds are non-toxic.

Novel and highly efficient preparation of pyrroles using supported ionic liquid ILCF3SO3@SiO2 as a heterogeneous catalyst

Abstract: A supported ionic liquid ILCF3SO3@SiO2 was synthesized and used as a highly efficient catalyst in the Paal–Knorr reaction for the preparation of pyrroles. The heterogeneous catalyst could be easily recovered and recycled for five times without noticeable loss of catalytic activity. Also a possible reaction mechanism is provided.