2740-83-2

Basic information

• Product Name: 3-(Trifluoromethyl)benzylamine
• Synonyms: 3-(Trifluoromethyl)benzylamine 98%;3-(Trifluoromethyl)benzylamine98%;Benzenemethanamine, 3-(trifluoromethyl)-;1-[3-(trifluoromethyl)phenyl]methanamine;3-(Trifluoromethyl)benzenemethanamine;3-(Trifluoromethyl)b;3-(Aminomethyl)benzotrifluoride, [3-(Trifluoromethyl)phenyl]methylamine;3-(TrifluoroMethyl)benzylaMine, 98% 5GR
• CAS NO: 2740-83-2
• Molecular Formula: C₈H₈F₃N
• Molecular Weight: 175.15
• EINECS: 220-367-2
• Product Categories: Anilines, Aromatic Amines and Nitro Compounds;Amine;Amines;C8;Nitrogen Compounds;Fluorine series
• Mol File: 2740-83-2.mol
• Article Data: 16

Chemical Properties

• Melting Point: 176.5-178.5 °C
• Boiling Point: 93-97 °C (22 mmHg)
• Flash Point: 160 °F
• Appearance: Clear colorless to yellow/Liquid
• Density: 1.222 g/mL at 25 °C(lit.)
• Vapor Pressure: 0.89mmHg at 25°C
• Refractive Index: n20/D 1.463(lit.)
• Storage Temp.: Store below +30°C.
• PKA: 8.69±0.10(Predicted)
• Water Solubility: insoluble
• Sensitive: Air Sensitive
• BRN: 1102465
• CAS DataBase Reference: 3-(Trifluoromethyl)benzylamine(CAS DataBase Reference)
• NIST Chemistry Reference: 3-(Trifluoromethyl)benzylamine(2740-83-2)
• EPA Substance Registry System: 3-(Trifluoromethyl)benzylamine(2740-83-2)

Safety Data

• Hazard Codes: C
• Statements: 22-34
• Safety Statements: 26-36/37/39-45
• RIDADR: UN 2735 8/PG 3
• WGK Germany: 2
• HazardClass: 8
• PackingGroup: III
• Hazardous Substances Data: 2740-83-2(Hazardous Substances Data)

Usage

Description

3-(Trifluoromethyl)benzylamine is a clear colorless to yellowish liquid with chemical properties that make it suitable for various applications in different industries.

Uses

Used in Pharmaceutical Industry:
3-(Trifluoromethyl)benzylamine is used as a chemical intermediate for the synthesis of various pharmaceutical compounds, specifically in the preparation of 6-substituted purines. These purines are essential in the development of medications targeting a wide range of health conditions.
Used in Chemical Synthesis:
3-(Trifluoromethyl)benzylamine is also used as a reagent in the chemical synthesis of various organic compounds, taking advantage of its unique trifluoromethyl group and benzylamine structure to create a diverse array of molecules with potential applications in different fields.
Used in Research and Development:
In the field of research and development, 3-(Trifluoromethyl)benzylamine serves as a valuable compound for exploring new chemical reactions and developing innovative synthetic pathways. Its unique properties make it a useful tool for scientists and researchers working on the design and synthesis of novel molecules with potential applications in various industries.

InChI:InChI=1/C8H8F3N/c9-8(10,11)7-3-1-2-6(4-7)5-12/h1-4H,5,12H2/p+1

Upstream product

• 368-77-4 3-trifluoromethylbenzonitrile 
• 368-83-2 3-(trifluoromethyl)benzaldehyde oxime 
• 402-23-3 1-bromomethyl-3-trifluoromethylbenzene 
• 227616-77-5 (6S)-3-{[(Benzyloxy)carbonyl]amino}-4-oxo-4,6,7,8-tetrahydropyrrolo[1,2-a]pyrimidine-6-carboxylic acid 
• 454-89-7 3-Trifluoromethylbenzaldehyde 
• 100-46-9 benzylamine 
• 109-73-9 N-butylamine 

Downstream Products

• 62666-36-8 4-{[1-(5-Fluoro-2-hydroxy-phenyl)-1-phenyl-meth-(E)-ylidene]-amino}-N-(3-trifluoromethyl-benzyl)-butyramide 
• 61290-79-7 1-(2-Hydroxy-ethyl)-1-methyl-3-(3-trifluoromethyl-benzyl)-thiourea 
• 143017-69-0 1,1,1,3,3,3-Hexamethyl-2-(3-trifluoromethyl-benzyl)-disilazane 
• 2740-85-4 1-(isothiocyanatomethyl)-3-(trifluoromethyl)benzene 
• 114467-10-6 C₁₄H₁₁F₃NO₃S*H⁽¹⁺⁾ 
• 114467-08-2 C₁₄H₁₀BrF₃NO₃S*H⁽¹⁺⁾ 
• 80953-46-4 C₁₅H₁₀F₆NO₃S*H⁽¹⁺⁾ 
• 114467-07-1 C₁₄H₁₀F₃N₂O₅S*H⁽¹⁺⁾ 
• 114467-09-3 C₁₆H₉F₉NO₃S*H⁽¹⁺⁾ 
• 1053615-41-0 (3aS,4S,6R,6aR)-2,2-Dimethyl-6-[6-(3-trifluoromethyl-benzylamino)-purin-9-yl]-tetrahydro-furo[3,4-d][1,3]dioxole-4-carboxylic acid methylamide 
• 454-89-7 3-Trifluoromethylbenzaldehyde 
• 79988-63-9 6-(3-Trifluoromethyl-benzyl)-5,6,7,8-tetrahydro-pyrimido[4,5-d]pyrimidine-2,4-diamine 
• 52794-59-9 3-(trifluoromethyl)phenylmethyl isocyanate 
• 175352-79-1 N-(diphenylmethylene)-3-trifluoromethylbenzenemethanamine 

Relevant articles and documents

Benzimidazole fragment containing Mn-complex catalyzed hydrosilylation of ketones and nitriles

The synthesis of a new bidentate (NN)–Mn(I) complex is reported and its catalytic activity towards the reduction of ketones and nitriles is studied. On comparing the reactivity of various other Mn(I) complexes supported by benzimidazole ligand, it was observed that the Mn(I) complexes bearing 6-methylpyridine and benzimidazole fragments exhibited the highest catalytic activity towards monohydrosilylation of ketones and dihydrosilylation of nitriles. Using this protocol, a wide range of ketones were selectively reduced to the corresponding silyl ethers. In case of unsaturated ketones, the chemoselective reduction of carbonyl group over olefinic bonds was observed. Additionally, selective dihydrosilylation of several nitriles were also achieved using this complex. Mechanistic investigations with radical scavengers suggested the involvement of radical species during the catalytic reaction. Stoichiometric reaction of the Mn(I) complex with phenylsilane revealed the formation of a new Mn(I) complex.

Chemo-selective reduction of nitro and nitrile compounds using Ni nanoparticles immobilized on hyperbranched polymer-functionalized magnetic nanoparticles

The nitro and nitrile groups in aromatic and aliphatic compounds containing various reducible substituents such as carboxylic acid, ketone, aldehyde and halogen are selectively reduced to the corresponding amines in water as a green solvent with excellent yields by employing NaBH4 in the presence of Fe3O4@PAMAM/Ni(0)-b-PEG nanocatalyst. The morphology and structural features of the catalyst were characterized using various microscopic and spectroscopic techniques. The designed catalyst system because of it being covered with hydrophilic polymers is soluble in a wide range of solvents (e.g. water and ethanol) and suitable for immobilizing and stabilizing Ni nanoparticles in aqueous mediums. In addition, the catalyst can be easily recovered from a reaction mixture by applying an external magnetic field and can be reused up to six runs without significant loss of activity.

Stereoelectronic effects in the reaction of aromatic substrates catalysed by: Halomonas elongata transaminase and its mutants

A transaminase from Halomonas elongata and four mutants generated by an in silico-based design were recombinantly produced in E. coli, purified and applied to the amination of mono-substituted aromatic carbonyl-derivatives. While benzaldehyde derivatives were excellent substrates, only NO2-acetophenones were transformed into the (S)-amine with a high enantioselectivity. The different behaviour of wild-type and mutated transaminases was assessed by in silico substrate binding mode studies.