4-(3-Fluorophenyl)piperidin-4-ol

Base Information

• Chemical Name: 4-(3-Fluorophenyl)piperidin-4-ol
• CAS No.: 80119-54-6
• Molecular Formula: C11H14FNO
• Molecular Weight: 195.237
• DSSTox Substance ID: DTXSID60509286
• Wikidata: Q82366740
• Mol file: 80119-54-6.mol

Synonyms:4-(3-fluorophenyl)piperidin-4-ol;80119-54-6;4-(3-FLUOROPHENYL)-4-PIPERIDINOL;4-(3-FLUORO-PHENYL)-PIPERIDIN-4-OL;SCHEMBL3153964;DTXSID60509286;XFSVMZMGUSRBJJ-UHFFFAOYSA-N;MFCD08689268;AKOS000266654;MB06463;PS-0045;CS-0317160;EN300-2778879

Chemical Property of 4-(3-Fluorophenyl)piperidin-4-ol

Chemical Property:

• PSA: 32.26000
• LogP: 1.72550
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 195.105942232
• Heavy Atom Count: 14
• Complexity: 192

Purity/Quality:

98%min ^*data from raw suppliers

4-(3-Fluorophenyl)-4-piperidinol AldrichCPR ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CNCCC1(C2=CC(=CC=C2)F)O

Technology Process of 4-(3-Fluorophenyl)piperidin-4-ol

There total 3 articles about 4-(3-Fluorophenyl)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:

tert-butyl 4-(3-fluorophenyl)-4-hydroxy-piperidine-1-carboxylate → 4-(3-fluorophenyl)-4-piperidinol (80119-54-6)

Guidance literature:

With hydrogenchloride; In ethyl acetate; at 20 ℃;

DOI:10.1016/j.bmcl.2010.11.029

Reference yield:

3-fluorobromobenzene (1073-06-9) → 4-(3-fluorophenyl)-4-piperidinol (80119-54-6)

Guidance literature:

Multi-step reaction with 2 steps

1.1: n-butyllithium / tetrahydrofuran / 0.5 h / -78 °C

1.2: 2 h / -78 - 20 °C / Inert atmosphere

2.1: hydrogenchloride / 1,4-dioxane / 2 h / 20 °C

With hydrogenchloride; n-butyllithium; In tetrahydrofuran; 1,4-dioxane;

Reference yield:

1-phenylmethyl-4-piperidone (3612-20-2) + bromo(3-fluorophenyl)magnesium (17318-03-5) → 4-(3-fluorophenyl)-4-piperidinol (80119-54-6)

Guidance literature:

Multi-step reaction with 2 steps

1: tetrahydrofuran / 2 h / 20 °C

2: 10 wt% Pd(OH)2 on carbon; hydrogen / methanol

With 10 wt% Pd(OH)2 on carbon; hydrogen; In tetrahydrofuran; methanol;

upstream raw materials:

1-phenylmethyl-4-piperidone

bromo(3-fluorophenyl)magnesium

3-fluorobromobenzene

Downstream raw materials:

6-(2-(4-(3-Fluorophenyl)-1,2,3,6-tetrahydropyrid-1-yl)ethyl)quinoline

C₂₀H₁₉FN₄O₃

C₂₀H₂₁FN₄O

C₂₉H₂₆F₄N₄O₄

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