1221722-10-6

Basic information

• Product Name: 2-Methyl-3-(4-trifluoromethoxyphenyl)benzoic acid
• Synonyms: 2-Methyl-3-(4-trifluoromethoxyphenyl)benzoic acid;2-Methyl-4'-(trifluoroMethoxy)biphenyl-3-carboxylic acid;2-methyl-4'-(trifluoromethoxy)-[1,1'-biphenyl]-3-carboxylic acid
• CAS NO: 1221722-10-6
• Molecular Formula: C15H11F3O3
• Molecular Weight: 296.2412496
• Mol File: 1221722-10-6.mol
• Article Data: 6

Chemical Properties

• Boiling Point: 374.0±42.0 °C(Predicted)
• Appearance: /
• Density: 1.322±0.06 g/cm3(Predicted)
• Storage Temp.: 2-8°C
• Solubility: DMSO (Slightly), Methanol (Slightly)
• PKA: 3.78±0.10(Predicted)
• CAS DataBase Reference: 2-Methyl-3-(4-trifluoromethoxyphenyl)benzoic acid(CAS DataBase Reference)
• NIST Chemistry Reference: 2-Methyl-3-(4-trifluoromethoxyphenyl)benzoic acid(1221722-10-6)
• EPA Substance Registry System: 2-Methyl-3-(4-trifluoromethoxyphenyl)benzoic acid(1221722-10-6)

Safety Data

• Hazardous Substances Data: 1221722-10-6(Hazardous Substances Data)

Usage

General Description

2-Methyl-3-(4-trifluoromethoxyphenyl)benzoic acid is an organic compound classified into the category of phenylbenzoic acids and derivatives. This chemical is characterized by the presence of a benzoic acid component with a methyl group at the second carbon position and a trifluoromethoxyphenyl group attached at the third carbon point. The trifluoromethoxyphenyl part is a phenyl ring that contains a trifluoromethoxy group, which includes three fluorine atoms, a carbon, and an oxygen, indicating this compound's potential to form fluorinated derivatives. Its physical properties can vary significantly. These compounds are typically used in sectors such as pharmaceuticals, manufacturing of substances, and scientific research.

Upstream product

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Downstream Products

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Relevant articles and documents

Large-steric-hindrance N-heterocyclic carbene palladium complex, preparation method and application thereof, and synthesis method of sonidegib based on large-steric-hindrance N-heterocyclic carbene palladium complex

The invention belongs to the technical field of organic synthesis and chemical catalysis, and discloses a large-steric-hindrance N-heterocyclic carbene palladium complex, a preparation method thereof,an application of the complex in efficient catalysis of a C-N coupling reaction under a room-temperature air condition, and a synthesis method of sonidegib based on the complex. According to the large-steric-hindrance N-heterocyclic carbene palladium complex, diphenyl imidazole serves as a main ligand framework, functionalized allyl serves as an auxiliary ligand, the functionalized allyl is introduced beside a metal center of a catalyst to serve as an auxiliary ligand, the catalytic activity and stability are remarkably improved, the large-steric-hindrance N-heterocyclic carbene palladium complex can be applied to efficient catalysis of a CN coupling reaction, particularly, the CN coupling reaction can be efficiently catalyzed under the room temperature condition, and the yield can reachup to 99%. The invention also provides a method for synthesizing sonidegib by taking aryl/aliphatic amine and aryl chloride as reactants and a three-step method at room temperature under the catalysisof a palladium catalytic system, the synthetic method has few steps, and the total yield can reach 74.5%.

PROCESS FOR THE PREPARATION OF N-[6-(CIS-2,6-DIMETHYLMORPHOLIN-4-YL)PYRIDINE-3-YL]-2- METHYL-4'-(TRIFIUOROMETHOXY) [1,1' -BIPHENYI]-3-CARBOXAMIDE AND ITS POLYMORPHS THEREOF

The present invention relates to process for the preparation of N-[6-(cis-2,6-dimethyl morpholin-4-yl)pyridine-3-yl]-2-methyl-4' -(trifluoromethoxy) [1,1'-biphenyl]-3-carboxamide compound of formula-1, it's salts and their polymorphs thereof.

METABOLITES OF SONIDEGIB (LDE225)

Provided herein are metabolites of N-(6-((2R,6S)-2,6-dimethylmorpholino)pyridin-3-yl)- 2-methyl-4'-(trifluoromethoxy)-[1,1'-biphenyl]-3-carboxamide (Sonidegib, LDE225) that modulate the activity of the Hedgehog signaling pathway and that are useful in the