(R)-2,2,2-Trifluoro-1-phenylethanamine

Base Information

• Chemical Name: (R)-2,2,2-Trifluoro-1-phenylethanamine
• CAS No.: 22038-85-3
• Molecular Formula: C8H8F3N
• Molecular Weight: 175.153
• Hs Code.: 2921499090
• European Community (EC) Number: 244-747-2
• Nikkaji Number: J57.122I
• Mol file: 22038-85-3.mol

Synonyms:22038-85-3;(R)-2,2,2-Trifluoro-1-phenylethanamine;(R)-2,2,2-TRIFLUORO-1-PHENYL-ETHYLAMINE;(1R)-2,2,2-trifluoro-1-phenylethanamine;(R)-2,2,2-trifluoro-1-phenylethan-1-amine;MFCD06738691;(1R)-2,2,2-trifluoro-1-phenylethan-1-amine;SCHEMBL1455757;AKOS006238590;AKOS015924747;AC-29421;DS-13278;CS-0005286;NS00049186;[(1R)-2,2,2-trifluoro-1-phenylethyl]amine;EN300-1642838;(1R)-2,2,2-tris(fluoranyl)-1-phenyl-ethanamine;A815857;(R)-2,2,2-Trifluoro-1-phenyl-ethylamine, AldrichCPR

Chemical Property of (R)-2,2,2-Trifluoro-1-phenylethanamine

Chemical Property:

• Boiling Point: 196.418 °C at 760 mmHg
• Flash Point: 78.877 °C
• PSA: 26.02000
• Density: 1.224g/cm³
• LogP: 2.94900
• Storage Temp.: 2-8°C(protect from light)
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 175.06088375
• Heavy Atom Count: 12
• Complexity: 138

Purity/Quality:

98%min ^*data from raw suppliers

(R)-2,2,2-Trifluoro-1-phenylethanamine ^*data from reagent suppliers

Safty Information:

• Statements: 34
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C(C(F)(F)F)N
• Isomeric SMILES: C1=CC=C(C=C1)[C@H](C(F)(F)F)N

Technology Process of (R)-2,2,2-Trifluoro-1-phenylethanamine

There total 18 articles about (R)-2,2,2-Trifluoro-1-phenylethanamine which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 97.0%

(S)-2-methyl-N-[(1R)-2,2,2-trifluoro-1-phenylethyl]propane-2-sulfinamide → (R)-(-)-2,2,2-Trifluoro-1-phenylethylamine (22038-85-3)

Guidance literature:

With hydrogenchloride; In 1,4-dioxane; methanol; at 20 ℃; for 0.0333333h;

DOI:10.1021/acs.joc.6b01063

Reference yield: 72.0%

(R)-2,2,2-trifluoro-1-phenylethan-1-amine hydrochloride (128404-37-5,189350-64-9) → (R)-(-)-2,2,2-Trifluoro-1-phenylethylamine (22038-85-3)

Guidance literature:

With triethylamine; In diethyl ether; Inert atmosphere;

DOI:10.1002/ejoc.200901158

Reference yield: 70.0%

2,2,2-trifluoroacetophenone oxime (655-25-4) → (R)-(-)-2,2,2-Trifluoro-1-phenylethylamine (22038-85-3)

Guidance literature:

With hydrogen; acetic acid; palladium on activated charcoal; In diethyl ether; at 20 - 25 ℃; under 2068.6 - 2327.2 Torr;

DOI:10.1016/S0040-4039(00)74468-6

upstream raw materials:

2,2,2-trifluoroacetophenone oxime

[1-Phenyl-eth-(E)-ylidene]-((R)-2,2,2-trifluoro-1-phenyl-ethyl)-amine

phenylmagnesium bromide

(αS)-α-(trifluoromethyl)-N-[(S)-1-phenylethyl]benzenemethanamine

Downstream raw materials:

(R)-5-methyl-8-[2,2,2-trifluoro-1-phenylethyl]-7,8-dihydro-6H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-a]pyrimidine

6-(ethylsulfonyl)-7-(methyloxy)-3-{[4-(4-morpholinyl)-1-piperidinyl]methyl}-2-[3-(trifluoromethyl)phenyl]N-[(1R)-2,2,2-trifluoro-1-phenylethyl]-4-quinolinecarboxamide

7-(ethyloxy)-6-(methylsulfonyl)-3-{[4-(4-morpholinyl)-1-piperidinyl]methyl}-2-[3-(trifluoromethyl)phenyl]-N-[(1R)-2,2,2-trifluoro-1-phenylethyl]-4-quinolinecarboxamide

7-[(1-methylethyl)oxy]-6-(methylsulfonyl)-3-{[4-(4-morpholinyl)-1-piperidinyl]methyl}-2-[3-(trifluoromethyl)phenyl]N-[(1R)-2,2,2-trifluoro-1-phenylethyl]-4-quinolinecarboxamide

Refernces

• 1、 Vazquez-Chavez, Josué,Luna-Morales, Socorro,Cruz-Aguilar, Diego A.,Díaz-Salazar, Howard,Vallejo Narváez, Wilmer E.,Silva-Gutiérrez, Rodrigo S.,Hernández-Ortega, Simón,Rocha-Rinza, Tomás,Hernández-Rodríguez, Marcos. "The effect of chiral: N-substituents with methyl or trifluoromethyl groups on the catalytic performance of mono-and bifunctional thioureas". . p. 10045 - 10051. Retrieved 2019/12/23.
• 2、 Holzer, Anja K.,Hiebler, Katharina,Mutti, Francesco G.,Simon, Robert C.,Lauterbach, Lars,Lenz, Oliver,Kroutil, Wolfgang. "Asymmetric Biocatalytic Amination of Ketones at the Expense of NH3 and Molecular Hydrogen". supporting information. p. 2431 - 2433. Retrieved 2015/06/02.