trans-1-Benzyl-4-(4-fluorophenyl)piperidin-3-yl]methanol

Base Information

• Chemical Name: trans-1-Benzyl-4-(4-fluorophenyl)piperidin-3-yl]methanol
• CAS No.: 188869-25-2
• Molecular Formula: C19H22FNO
• Molecular Weight: 0.00000
• DSSTox Substance ID: DTXSID501159546
• Nikkaji Number: J1.944.597F
• Mol file: 188869-25-2.mol

Synonyms:188869-25-2;SCHEMBL4029196;trans-1-Benzyl-4-(4-fluorophenyl)piperidin-3-yl]methanol;DTXSID501159546;CS-0232239;Rac-[(3r,4s)-1-benzyl-4-(4-fluorophenyl)piperidin-3-yl]methanol, trans;rel-(3R,4S)-4-(4-Fluorophenyl)-1-(phenylmethyl)-3-piperidinemethanol

Chemical Property of trans-1-Benzyl-4-(4-fluorophenyl)piperidin-3-yl]methanol

Chemical Property:

• PSA: 0.00000
• LogP: 0.00000
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 299.16854249
• Heavy Atom Count: 22
• Complexity: 323

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CN(CC(C1C2=CC=C(C=C2)F)CO)CC3=CC=CC=C3
• Isomeric SMILES: C1CN(C[C@@H]([C@H]1C2=CC=C(C=C2)F)CO)CC3=CC=CC=C3

Technology Process of trans-1-Benzyl-4-(4-fluorophenyl)piperidin-3-yl]methanol

There total 75 articles about trans-1-Benzyl-4-(4-fluorophenyl)piperidin-3-yl]methanol 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: 100.0%

isobutyl (3S,4R)-1-benzyl-4-(4-fluorophenyl)piperidine-3-carboxylate (369593-39-5) → (3S,4R)-[1-benzyl-4-piperidin-3-yl-4-(4-fluorophenyl)]methanol (201855-60-9,188869-25-2)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; at 0 - 20 ℃; for 0.833333h;

DOI:10.1016/S0040-4039(01)01096-6

Reference yield: 100.0%

(4RS,5SR)-1-benzyl-4-(4-fluorophenyl)-5-(methoxycarbonyl)piperidin-2-one → (3RS,4SR)-1-benzyl-4-(4-fluorophenyl)3-(hydroxymethyl)piperidine (188869-25-2)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; Heating;

DOI:10.1016/j.tetlet.2003.08.025

Reference yield: 94.5%

(+)-1-benzyl-4-(4-fluorophenyl)-3-hydroxymethyl-1,2,3,6-tetrahydropiridine → (-)-trans-1-benzyl-4-(4-fluorophenyl)-3-hydroxymethylpiperidine (188869-25-2)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; for 4h; Heating / reflux;

upstream raw materials:

(3R,4S)-methyl-1-benzyl-4-(4-fluorophenyl)-2-oxopiperidine-3-carboxylate

malonic acid dibenzyl ester

trans-4-fluorocinnamaldehyde

benzylamine

Downstream raw materials:

(3S,4R)-1-benzyl-4-(4-fluorophenyl)-3-[3,4-(methylenedioxy)-phenoxymethyl]piperidine

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