231291-22-8

Basic information

• Product Name: 6-(Trifluoromethyl)nicotinic acid
• Synonyms: 6-(TRIFLUOROMETHYL)NICOTINIC ACID;3-Pyridinecarboxylicacid, 6-(trifluoroMethyl)-;6-(Trifluoromethyl)pyridine-3-carboxylic acid, 5-Carboxy-2-(trifluoromethyl)pyridine;6- threefluorine Methylnicotinate;6-Trifluoromethylnicotic acid;6-(TRIFLUOROMETHYL)PYRIDINE-3-CARBOXYLIC ACID;2-TRIFLUOROMETHYL-5-PYRIDINECARBOXYLIC ACID;RARECHEM AL BO 1001
• CAS NO: 231291-22-8
• Molecular Formula: C₇H₄F₃NO₂
• Molecular Weight: 191.11
• EINECS: 1312995-182-4
• Product Categories: Nitrogen cyclic compounds;Pyridine Series;Acids and Derivatives;Heterocycles;Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts;Carboxylic Acids;Pyridines;Pyridine;Niacin;Pyridines derivates;Heterocycle;Carboxylic Acids;Building Blocks;Aromatics
• Mol File: 231291-22-8.mol
• Article Data: 9

Chemical Properties

• Melting Point: 193-197 °C(lit.)
• Boiling Point: 259.322 °C at 760 mmHg
• Flash Point: 110.634 °C
• Appearance: white solid
• Density: 1.485 g/cm³
• Vapor Pressure: 0.007mmHg at 25°C
• Refractive Index: 1.475
• Storage Temp.: Inert atmosphere,Room Temperature
• Solubility: Acetonitrile (Slightly), Methanol (Slightly)
• PKA: 2.96±0.10(Predicted)
• CAS DataBase Reference: 6-(Trifluoromethyl)nicotinic acid(CAS DataBase Reference)
• NIST Chemistry Reference: 6-(Trifluoromethyl)nicotinic acid(231291-22-8)
• EPA Substance Registry System: 6-(Trifluoromethyl)nicotinic acid(231291-22-8)

Safety Data

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36
• WGK Germany: 3
• HazardClass: IRRITANT
• Hazardous Substances Data: 231291-22-8(Hazardous Substances Data)

Usage

Description

6-(Trifluoromethyl)nicotinic acid, also known as 6-TFNA, is a chemical compound belonging to the nicotinic acid family. It is characterized by the presence of a trifluoromethyl group at the 6th position of the nicotinic acid molecule. 6-(Trifluoromethyl)nicotinic acid exhibits a white powdery appearance with distinct physical properties, including a melting point of 193-197 °C, a boiling point of 259.3℃ at 760 mmHg, a density of 1.484 g/cm3, a flash point of 110.6℃, a refractive index of 1.475, and a vapor pressure of 0.007mmHg at 25°C.

Uses

Used in Pharmaceutical Industry:
6-(Trifluoromethyl)nicotinic acid is used as a key intermediate compound for the synthesis of Raf inhibitors, which are crucial in the development of cancer treatment drugs. Raf inhibitors are designed to target and inhibit the Raf protein, a component of the MAPK/ERK signaling pathway that plays a significant role in cell growth and proliferation. By inhibiting the Raf protein, these inhibitors can effectively suppress the growth and progression of cancer cells, particularly in solid malignancies.
The application of 6-(Trifluoromethyl)nicotinic acid in the pharmaceutical industry is primarily due to its potential role in the development of novel and effective cancer therapeutics. Its unique chemical structure allows for the creation of Raf inhibitors with improved pharmacological properties, such as enhanced potency, selectivity, and reduced side effects. As a result, 6-(Trifluoromethyl)nicotinic acid holds great promise in advancing cancer research and treatment options.

InChI:InChI=1/C7H4F3NO2/c8-7(9,10)5-2-1-4(3-11-5)6(12)13/h1-3H,(H,12,13)

Upstream product

• 124-38-9 carbon dioxide 
• 436799-32-5 5-bromo-2(trifluoromethyl)pyridine 
• 368-48-9 2-(trifluoromethyl)pyridine 
• 624-28-2 2,5-dibromopyridine 
• 30766-11-1 5-bromoisonicotinic acid 
• 223463-13-6 2-iodo-5-bromopyridine 
• 216431-85-5 6-(trifluoromethyl)nicotinonitrile 
• 64-19-7 acetic acid 

Downstream Products

• 358780-13-9 6-(trifluoromethyl)nicotinoyl chloride 
• 948551-74-4 5-isocyanato-2-(trifluoromethyl)pyridine 
• 325457-86-1 tert-butyl (6-(trifluoromethyl)pyridin-3-yl)carbamate 
• 386704-04-7 6-(trifluoromethyl)pyridin-3-ylmethanol 
• 1054611-63-0 C₃₂H₃₂F₃N₅O₄ 
• 1005787-46-1 N-[6-(3-{[3-(1-cyanocyclopropyl)benzoyl]amino}phenoxy)imidazo[1,2-b]pyridazin-2-yl]-6-(trifluoromethyl)nicotinamide 
• 1195760-40-7 N-(2-aminophenyl)-6-(2-((6-trifluoromethyl-pyridin-3-ylcarbonyl)amino)-ethylamino)nicotinamide 
• 1181898-22-5 N-cyclohexyl-6-(trifluoromethyl)-3-pyridinecarboxamide 
• 1244760-81-3 C₂₄H₂₅F₃N₆O 
• 386704-12-7 6-(trifluoromethyl)pyridine-3-carbaldehyde 
• 1179905-36-2 3-(4-fluoro-3-trifluoromethylphenyl)-5,5-dimethyl-1-(6-trifluoromethyl-pyridin-3-ylmethyl)imidazolidine-2,4-dione 
• 416852-53-4 N-methoxy-N-methyl-6-(trifluoromethyl)pyridine-3-carboxamide 
• 358780-14-0 1-[(6-trifluoromethyl)-pyridine-3-yl]ethan-1-one 
• 1417700-41-4 C₂₄H₂₂F₄N₄O₂ 

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