32890-94-1

Basic information

• Product Name: 2-FLUORO-6-(TRIFLUOROMETHYL)BENZOIC ACID
• Synonyms: RARECHEM AL BO 0626;OTF-BOA-6F;2-FLUORO-6-(TRIFLUOROMETHYL)BENZOIC ACID;BUTTPARK 29\06-66;alpha,alpha,alpha,6-Tetrafluoro-o-toluic acid;2-Fluoro-6-(trifluoromethyl)benzoic acid, 97+%;à,à,à,6-tetrafluoro-o-toluic acid;2-Fluoro-6-(trifluoromethyl)benzoic acid 98%
• CAS NO: 32890-94-1
• Molecular Formula: C₈H₄F₄O₂
• Molecular Weight: 208.11
• Product Categories: Aryl;Building Blocks;Carboxy;C8;Carbonyl Compounds;Carboxylic Acids;Carbonyl Compounds;Carboxylic Acids;Chemical Synthesis;Fluorinated Building Blocks;Organic Building Blocks;Organic Fluorinated Building Blocks;Trifluoromethyl;Fluorine series
• Mol File: 32890-94-1.mol

Chemical Properties

• Melting Point: 85-87 °C(lit.)
• Boiling Point: 232℃
• Flash Point: 94℃
• Appearance: White to pale yellow/Crystalline Chunks
• Density: 1.489
• Vapor Pressure: 0.0339mmHg at 25°C
• Storage Temp.: Sealed in dry,Room Temperature
• Solubility: soluble in Methanol
• PKA: 2.30±0.36(Predicted)
• BRN: 2112882
• CAS DataBase Reference: 2-FLUORO-6-(TRIFLUOROMETHYL)BENZOIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: 2-FLUORO-6-(TRIFLUOROMETHYL)BENZOIC ACID(32890-94-1)
• EPA Substance Registry System: 2-FLUORO-6-(TRIFLUOROMETHYL)BENZOIC ACID(32890-94-1)

Safety Data

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-37/39-36
• WGK Germany: 3
• HazardClass: IRRITANT
• Hazardous Substances Data: 32890-94-1(Hazardous Substances Data)

Usage

Uses

Used in Chemical Synthesis:
2-Fluoro-6-(trifluoromethyl)benzoic acid is used as a key intermediate in the synthesis of various pharmaceuticals, agrochemicals, and other specialty chemicals. Its unique structure and reactivity make it a valuable building block for creating complex molecules with specific biological activities.
Used in Pharmaceutical Industry:
In the pharmaceutical industry, 2-Fluoro-6-(trifluoromethyl)benzoic acid is used as a starting material for the development of new drugs. Its fluorinated structure can enhance the lipophilicity and metabolic stability of the resulting compounds, potentially leading to improved drug efficacy and reduced side effects.
Used in Agrochemical Industry:
2-Fluoro-6-(trifluoromethyl)benzoic acid is also utilized in the agrochemical industry for the synthesis of novel pesticides and herbicides. The introduction of fluorine and trifluoromethyl groups can significantly alter the biological activity and selectivity of the final products, making them more effective and environmentally friendly.
Used in Material Science:
In the field of material science, 2-Fluoro-6-(trifluoromethyl)benzoic acid can be employed in the development of advanced materials with specific properties, such as improved thermal stability, chemical resistance, or optical characteristics. Its unique structure allows for the creation of new polymers, coatings, and composites with enhanced performance.

InChI:InChI=1/C8H4F4O2/c9-5-3-1-2-4(8(10,11)12)6(5)7(13)14/h1-3H,(H,13,14)/p-1

Upstream product

• 109-72-8 n-butyllithium 
• 401-80-9 3-fluoro-trifluoromethylbenzene 
• 60611-24-7 2-fluoro-6-(trifluoromethyl)benzaldehyde 
• 124-38-9 carbon dioxide 

Downstream Products

• 343850-72-6 N-[(2-fluoro-6-(trifluoromethyl)phenyl)carbonyl]-4-(1,3,6-trimethyl-2,4-dioxo-5-pyrimidinyl)-L-phenylalanine 
• 924636-95-3 C₂₂H₁₆F₄N₂O 
• 239087-06-0 (2-fluoro-6-(trifluoromethyl) phenyl)methanamine 
• 152211-15-9 (2-fluoro-6-(trifluoromethyl)phenyl)methanol 
• 2118332-08-2 2-fluoro-6-(trifluoromethyl)benzoic anhydride 
• 1093989-03-7 3-chloro-5-{[6-chloro-2-fluoro-3-({5-[2-fluoro-6-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl}methyl)phenyl]oxy}benzonitrile 
• 401-80-9 3-fluoro-trifluoromethylbenzene 
• 1206164-20-6 potassium 2-fluoro-6-(trifluoromethyl)benzoate 
• 313675-36-4 2-{4-[2-(3,4-Dichloro-phenyl)-ethyl]-phenylamino}-6-trifluoromethyl-benzoic acid 
• 164341-33-7 6-Fluoro-2-trifluoromethylbenzoylguanidine hydrochloride 

Relevant articles and documents

Preparation method of 2-fluoro-6-(trifluoromethyl) benzamide

The invention provides a preparation method of 2-fluoro-6-(trifluoromethyl) benzamide, which comprises the following steps: adding an acid-binding agent and a chlorinating agent into an organic solution of 2-fluoro-6-(trifluoromethyl) benzoic acid, carrying out acylating chlorination on the 2-fluoro-6-(trifluoromethyl) benzoic acid, and then adding an aminating agent to amidate the 2-fluoro-6-(trifluoromethyl) benzoyl chloride. The preparation method of 2-fluoro-6-(trifluoromethyl) benzamide provided by the invention has the advantages of simple steps, superior quality, high yield and high purity, and is suitable for industrial production.

Preparation method of Elagolix intermediate 2-fluoro-6-trifluoromethyl benzylamine

The invention discloses a preparation method of an Elagolix intermediate 2-fluoro-6-trifluoromethyl benzylamine, and belongs to the technical field of medical intermediates. The preparation method comprises the following steps: (1) synthesizing 2-fluoro-6-(trifluoromethyl) benzyl alcohol; (2) synthesizing 2-fluoro-6-(trifluoromethyl) benzyl alcohol; (3) synthesizing a 2-fluoro-6-(trifluoromethyl)benzenemethanesulfonate compound and a phthalimide compound; (4) directly synthesizing a phthalimide compound; (5) synthesizing the 2-fluorine-6-trifluoromethyl benzylamine. According to the preparation method, factors such as a reaction reagent and a reaction solvent are optimized, so the reaction conditions are mild, the technological process is simple and convenient, the requirements on equipment are relatively low, the price of raw materials is lower, the purity of the obtained product is high, and industrial production is facilitated.

Substituted 1,2,4-triazolo[1,5-a]pyrimidine-2-sulfonamides, compositions containing them, and their utility as herbicides

Novel substituted triazolo[1,5-a]pyrimidine-2-sulfonamides, e.g., 5,7-dimethyl-N-(2,6-dichlorophenyl)-1,2,4-triazolo[1,5-a]pyrimidine-2-sulfonamide and their agriculturally acceptable salts are prepared. These compounds and compositions containing them are useful for the control of unwanted vegetation. Novel substituted triazolo[1,5-a]pyrimidine-2-sulfonyl chlorides and substituted anilines and their use as intermediates are also described.