1-Phenylpiperidin-4-amine dihydrochloride

Base Information

• Chemical Name: 1-Phenylpiperidin-4-amine dihydrochloride
• CAS No.: 1082662-38-1
• Molecular Formula: C₁₁H₁₆N₂*(x)ClH
• Molecular Weight: 249.18002
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID80705460
• Mol file: 1082662-38-1.mol

Synonyms:1-Phenylpiperidin-4-amine dihydrochloride;1082662-38-1;1-phenylpiperidin-4-amine;dihydrochloride;1-Phenylpiperidin-4-aminedihydrochloride;SCHEMBL17927700;DTXSID80705460;MFCD23135281;AKOS016003255;DS-2391;1-PHENYLPIPERIDIN-4-AMINE 2HCL;1-Phenyl-4-piperidinamine dihydrochloride;CS-0166773;A895305;1-Phenylpiperidin-4-amine--hydrogen chloride (1/2)

Chemical Property of 1-Phenylpiperidin-4-amine dihydrochloride

Chemical Property:

• Melting Point: 264-265 °C(Solv: ethanol (64-17-5); ethyl ether (60-29-7))
• PSA: 29.26000
• LogP: 3.98340
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 248.0847040
• Heavy Atom Count: 15
• Complexity: 144

Purity/Quality:

97% ^*data from raw suppliers

1-Phenylpiperidin-4-aminedihydrochloride >95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(CCC1N)C2=CC=CC=C2.Cl.Cl

Technology Process of 1-Phenylpiperidin-4-amine dihydrochloride

There total 3 articles about 1-Phenylpiperidin-4-amine dihydrochloride 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 (1-phenylpiperidin-4-yl)carbamate (1185314-73-1) → 1-phenylpiperidin-4-amine hydrochloride (1082662-38-1)

Guidance literature:

With hydrogenchloride; In ethyl acetate; at 20 ℃; for 0.5h;

Reference yield:

(piperidin-4-yl)carbamic acid tert-butyl ester (73874-95-0) → 1-phenylpiperidin-4-amine hydrochloride (1082662-38-1)

Guidance literature:

Multi-step reaction with 2 steps

1: sodium t-butanolate; tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene / 5,5-dimethyl-1,3-cyclohexadiene / 0.5 h / 120 °C / Inert atmosphere; Microwave irradiation

2: hydrogenchloride / ethyl acetate / 0.5 h / 20 °C

With hydrogenchloride; tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; sodium t-butanolate; In 5,5-dimethyl-1,3-cyclohexadiene; ethyl acetate;

Reference yield:

4-tolyl iodide (624-31-7) → 1-phenylpiperidin-4-amine hydrochloride (1082662-38-1)

Guidance literature:

Multi-step reaction with 2 steps

1: sodium t-butanolate; tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene / 5,5-dimethyl-1,3-cyclohexadiene / 0.5 h / 120 °C / Inert atmosphere; Microwave irradiation

2: hydrogenchloride / ethyl acetate / 0.5 h / 20 °C

With hydrogenchloride; tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; sodium t-butanolate; In 5,5-dimethyl-1,3-cyclohexadiene; ethyl acetate;

upstream raw materials:

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

4-tolyl iodide

tert-butyl (1-phenylpiperidin-4-yl)carbamate

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