4-(Trifluoromethyl)piperidin-4-ol

Base Information

• Chemical Name: 4-(Trifluoromethyl)piperidin-4-ol
• CAS No.: 373603-69-1
• Molecular Formula: C6H10F3NO
• Molecular Weight: 169.147
• Hs Code.: 2933399990
• DSSTox Substance ID: DTXSID201299783
• Mol file: 373603-69-1.mol

Synonyms:4-(Trifluoromethyl)piperidin-4-ol;373603-69-1;4-Trifluoromethyl-piperidin-4-ol;4-trifluoromethylpiperidin-4-ol;MFCD13179174;4-Piperidinol, 4-(trifluoromethyl)-;4-(Trifluoromethyl)-4-piperidinol;4-hydroxy-4-trifluoromethyl-piperidine;SCHEMBL1593885;AMY7085;DTXSID201299783;YPA60369;4-hydroxy-4-trifluoromethyl-piperdine;AKOS010288325;SB11672;BS-13522;SY097112;DB-069521;CS-0038010;EN300-58599

Chemical Property of 4-(Trifluoromethyl)piperidin-4-ol

Chemical Property:

• Boiling Point: 175.1±35.0 °C(Predicted)
• PKA: 12.23±0.20(Predicted)
• PSA: 32.26000
• Density: 1.291±0.06 g/cm3(Predicted)
• LogP: 0.99200
• Storage Temp.: 2-8°C(protect from light)
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 0
• Exact Mass: 169.07144843
• Heavy Atom Count: 11
• Complexity: 139

Purity/Quality:

99%, ^*data from raw suppliers

4-(Trifluoromethyl)piperidin-4-ol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CNCCC1(C(F)(F)F)O
• Uses: 4-(Trifluoromethyl)piperidin-4-ol is used for preparation of sulfonamide derivatives as amyloid β production inhibitors useful in treating or preventing diseases related to Aβ.

Technology Process of 4-(Trifluoromethyl)piperidin-4-ol

There total 1 articles about 4-(Trifluoromethyl)piperidin-4-ol 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:

benzyl 4-oxo-1-piperidinecarboxylate (19099-93-5) → 4-trifluoromethyl-4-hydroxypiperidine (373603-69-1)

Guidance literature:

Multi-step reaction with 2 steps

1: tetrabutyl ammonium fluoride / tetrahydrofuran / 0 - 30 °C

2: hydrogen / palladium 10% on activated carbon / ethanol / 20 °C

With tetrabutyl ammonium fluoride; hydrogen; palladium 10% on activated carbon; In tetrahydrofuran; ethanol;

Reference yield: 69.0%

4-trifluoromethyl-4-hydroxypiperidine (373603-69-1) + 2-{[5-bromo-1-(2-chlorophenyl)-1H-1,2,4-triazol-3-yl]methyl}-5-(4-chlorophenyl)-4-[(2S)-3,3,3-trifluoro-2-hydroxypropyl]-2,4-dihydro-3H-1,2,4-triazol-3-one → 5-(4-chlorophenyl)-2-({1-(2-chlorophenyl)-5-[4-hydroxy-4-(trifluoromethyl)piperidin-1-yl]-1H-1,2,4-triazol-3-yl}methyl)-4-[(2S)-3,3,3-trifluoro-2-hydroxypropyl]-2,4-dihydro-3H-1,2,4-triazol-3-one

Guidance literature:

With N-ethyl-N,N-diisopropylamine; In acetonitrile; at 180 ℃; for 5h; Microwave irradiation;

Reference yield: 64.0%

4-trifluoromethyl-4-hydroxypiperidine (373603-69-1) + 1-(5-chloro-2-(spiro[3.3]heptan-2-yl)phenoxy)-N-((6-fluoropyridin-2-yl)sulfonyl)cyclopropanecarboxamide → 1 -(5-chloro-2-(spiro[3.3]heptan-2-yl)phenoxy)-N-((6-(4-hydroxy-4-(trifluoromethyl)piperidin-1-yl)pyridin-2-yl)sulfonyl)cyclopropanecarboxamide

Guidance literature:

With potassium phosphate; In N,N-dimethyl acetamide; at 120 ℃; for 18h;

upstream raw materials:

benzyl 4-oxo-1-piperidinecarboxylate

Downstream raw materials:

1-(2-{4-[5-(4-chloro-phenyl)-pyridin-2-ylethynyl]-phenoxy}-ethyl)-4-trifluoromethyl-piperidin-4-ol

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