1-(4-Fluorophenyl)piperidin-4-amine

Base Information

• Chemical Name: 1-(4-Fluorophenyl)piperidin-4-amine
• CAS No.: 164721-12-4
• Molecular Formula: C11H15FN2
• Molecular Weight: 194.252
• Hs Code.: 2933399090
• European Community (EC) Number: 837-989-0
• DSSTox Substance ID: DTXSID40599266
• Wikidata: Q82495137
• Mol file: 164721-12-4.mol

Synonyms:1-(4-fluorophenyl)piperidin-4-amine;164721-12-4;4-Piperidinamine, 1-(4-fluorophenyl)-;1-(4-Fluorophenyl)piperidin-4-amine x1ch3cooh;SCHEMBL377434;DTXSID40599266;HLMQCQUHBXFHCK-UHFFFAOYSA-N;MFCD08059820;1-(4-fluorophenyl)piperidine-4-amine;AKOS000186179;SB42062;DB-180154;CS-0216625;EN300-52940;Z295882334

Chemical Property of 1-(4-Fluorophenyl)piperidin-4-amine

Chemical Property:

• Vapor Pressure: 0.000599mmHg at 25°C
• Boiling Point: 310.5°C at 760 mmHg
• PKA: 10.08±0.20(Predicted)
• Flash Point: 141.6°C
• PSA: 29.26000
• Density: 1.119g/cm³
• LogP: 2.51850
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 194.12192665
• Heavy Atom Count: 14
• Complexity: 170

Purity/Quality:

95-99% ^*data from raw suppliers

1-(4-Fluorophenyl)piperidin-4-amine 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(CCC1N)C2=CC=C(C=C2)F

Technology Process of 1-(4-Fluorophenyl)piperidin-4-amine

There total 4 articles about 1-(4-Fluorophenyl)piperidin-4-amine 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: 78.0%

→ 1-(4-fluorophenyl)piperidin-4-amine (164721-12-4)

Guidance literature:

With hydrogenchloride; In 1,4-dioxane; at 20 ℃;

Reference yield: 49.0%

tert-butyl N-[1-(4-fluorophenyl)piperidin-4-yl]carbamate (483366-29-6) → 1-(4-fluorophenyl)piperidin-4-amine (164721-12-4)

Guidance literature:

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

Reference yield:

(piperidin-4-yl)carbamic acid tert-butyl ester (73874-95-0) → 1-(4-fluorophenyl)piperidin-4-amine (164721-12-4)

Guidance literature:

Multi-step reaction with 2 steps

1: sodium t-butanolate; tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; ruphos / toluene / 16 h / 80 °C / Inert atmosphere

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

With hydrogenchloride; tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; sodium t-butanolate; ruphos; In 1,4-dioxane; water; toluene;

upstream raw materials:

tert-butyl N-[1-(4-fluorophenyl)piperidin-4-yl]carbamate

(piperidin-4-yl)carbamic acid tert-butyl ester

1-Bromo-4-fluorobenzene

Downstream raw materials:

4-[N-(4-Fluorophenyl)piperidin-4-ylamino]-3-chloro-2-methylpyridine

N-(1-(4-fluorophenyl)piperidin-4-yl)-3-methoxy-2-oxo-1-(2,2,2-trifluoroethyl)-1,2-dihydropyridine-4-carboxamide