104774-87-0

Basic information

• Product Name: 3-(3-TRIFLUOROMETHYL-PHENYL)-PROPYLAMINE
• Synonyms: RARECHEM AL BW 1078;3-(3-TRIFLUOROMETHYL-PHENYL)-PROPYLAMINE;3-(3-(TRIFLUOROMETHYL)PHENYL)PROPAN-1-AMINE;3-(TrifluoroMethyl)-benzenepropanaMine;3-[3-(Trifluoromethyl)phenyl]-1-propanamine
• CAS NO: 104774-87-0
• Molecular Formula: C₁₀H₁₂F₃N
• Molecular Weight: 203.2
• Mol File: 104774-87-0.mol
• Article Data: 9

Chemical Properties

• Boiling Point: 222.2±40.0 °C(Predicted)
• Appearance: /
• Density: 1.154±0.06 g/cm3(Predicted)
• Storage Temp.: Refrigerator, under inert atmosphere
• Solubility: Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
• PKA: 10.20±0.10(Predicted)
• CAS DataBase Reference: 3-(3-TRIFLUOROMETHYL-PHENYL)-PROPYLAMINE(CAS DataBase Reference)
• NIST Chemistry Reference: 3-(3-TRIFLUOROMETHYL-PHENYL)-PROPYLAMINE(104774-87-0)
• EPA Substance Registry System: 3-(3-TRIFLUOROMETHYL-PHENYL)-PROPYLAMINE(104774-87-0)

Safety Data

• Hazardous Substances Data: 104774-87-0(Hazardous Substances Data)

Usage

General Description

3-(3-trifluoromethyl-phenyl)-propylamine is a chemical compound with a molecular formula C10H13F3N. It is a derivative of propylamine with a trifluoromethyl-phenyl group attached to the third carbon. 3-(3-TRIFLUOROMETHYL-PHENYL)-PROPYLAMINE is commonly used in the field of chemical research as a building block for the synthesis of other compounds. It has been studied for its potential use in pharmaceuticals, particularly in the development of new drugs. 3-(3-trifluoromethyl-phenyl)-propylamine may also have applications in the production of agrochemicals and materials science due to its unique chemical properties.

Upstream product

• 95096-06-3 3-(3-(trifluoromethyl)phenyl)propanenitrile 
• 454-89-7 3-Trifluoromethylbenzaldehyde 
• 95728-83-9 3-[3-(trifluoromethyl)phenyl]-2-propenenitrile 
• 401-78-5 3-bromo-1-trifluoromethylbenzene 
• 60689-14-7 3-(3-(trifluoromethyl)phenyl)acryloyl chloride 
• 779-89-5 3-(trifluoromethyl)cinnamic acid 
• 64380-24-1 (E)-3-(3-(trifluoromethyl)phenyl)acrylamide 
• 60689-14-7 trans-3-(trifluoromethyl)cinnamoyl chloride 
• 535-53-5 3-(3-trifluoromethyl-phenyl)-propionic acid amide 
• 93040-58-5 T₀₅₀₂-9046 

Downstream Products

• 364782-34-3 cinacalcet hydrochloride 
• 226256-56-0 cinacalcet 
• 2074615-22-6 C₂₂H₂₂F₃N 
• 802918-46-3 [1-(7,8-dihydro-naphthalen-1-yl)-ethyl]-[3-(3-trifluoromethyl-phenyl)-propyl]-amine 
• 802918-47-4 [1-(5,6-dihydronaphthalen-1-yl)ethyl]-[3-(3-trifluoromethylphenyl)propyl]amine 
• 802918-36-1 [(R)-1-(5,6-Dihydro-naphthalen-1-yl)-ethyl]-[3-(3-trifluoromethyl-phenyl)-propyl]-amine 
• 802918-36-1 [(S)-1-(5,6-Dihydro-naphthalen-1-yl)-ethyl]-[3-(3-trifluoromethyl-phenyl)-propyl]-amine 
• 1020414-33-8 [1-(7,8-dihydronaphthalen-1-yl)-ethyl]-[3-(3-trifluoromethylphenyl)propyl]amine hydrochloride 

Relevant articles and documents

Synthesis of Cinacalcet congeners

Two related substances 1 and 2 of Cinacalet were prepared. Two racemic isomeric dihydronaphthalenes 1 and 2 were prepared from commercially available 5-hydroxytetralone in five linear steps. A key palladium-catalyzed double bond migration led to the synthesis of both isomers from the same starting material. Preparative chiral HPLC separation provided the enantiomerically pure materials. An asymmetric synthesis employing CBS reduction to furnish 1 was also developed.

Design, synthesis and biological evaluation of 8-(2-amino-1-hydroxyethyl)-6-hydroxy-1,4-benzoxazine-3(4H)-one derivatives as potent β2-adrenoceptor agonists

A series of β2-adrenoceptor agonists with an 8-(2-amino-1-hydroxyethyl)-6-hydroxy-1,4-benzoxazine-3(4H)-one moiety is presented. The stimulatory effects of the compounds on human β2-adrenoceptor and β1-adrenoceptor were characterized by a cell-based assay. Their smooth muscle relaxant activities were tested on isolated guinea pig trachea. Most of the compounds were found to be potent and selective agonists of the β2-adrenoceptor. One of the compounds, (R)-18c, possessed a strong β2-adrenoceptor agonistic effect with an EC50 value of 24 pM. It produced a full and potent airway smooth muscle relaxant effect same as olodaterol. Its onset of action was 3.5 min and its duration of action was more than 12 h in an in vitro guinea pig trachea model of bronchodilation. These results suggest that (R)-18c is a potential candidate for long-acting β2-AR agonists.

Dihydronaphthalene compounds, compositions, uses thereof, and methods for synthesis

The present invention relates to novel dihydronaphthalene compounds, compositions, methods for using the same, and processes for preparing the same. The present invention also relates to novel total synthesis approaches for preparing these compounds. In addition, the present invention relates to methods of producing quantities of isomers of these compounds and separating and purifying them using chiral separation techniques. The present invention also relates to methods of producing quantities of a single isometric compound without the need for chiral separation techniques.