1-Benzyl-4-cyano-4-phenylpiperidine Hydrochloride

Base Information

• Chemical Name: 1-Benzyl-4-cyano-4-phenylpiperidine Hydrochloride
• CAS No.: 71258-18-9
• Molecular Formula: C19H20 N2 . Cl H
• Molecular Weight: 312.842
• Hs Code.: 29333999
• European Community (EC) Number: 275-305-7
• NSC Number: 23832
• Mol file: 71258-18-9.mol

Synonyms:71258-18-9;1-Benzyl-4-cyano-4-phenylpiperidine Hydrochloride;1-benzyl-4-phenylpiperidine-4-carbonitrile hydrochloride;1-Benzyl-4-cyano-4-phenylpiperidine HCl;1-N-Benzyl-4-cyano-4-phenylpiperidine hydrochloride;1-benzyl-4-phenylpiperidine-4-carbonitrile;hydrochloride;NSC23832;C19H21ClN2;N-Benzyl-4-cyano-4-phenylpiperidine hydrochloride;SCHEMBL2473959;NIOSH/NS8800000;AMY2537;SPXFNRMZPRHYRH-UHFFFAOYSA-N;MFCD00035361;NSC-23832;AKOS015847373;AC-2975;AS-10909;B4393;CS-0171347;FT-0641342;NS00062235;NS88000000;F11589;1-benzyl-4-cyano4-phenylpiperidine hydrochloride;1-Benzyl-4-phenylisonipectonitrile, hydrochloride;EN300-12577777;Isopeconitrile, 1-benzyl-4-phenyl-, hydrochloride;N-Benzyl-4-cyano-4-phenyl piperidine hydrochloride;W-104528;1-Benzyl-4-phenylpiperidine-4-carbonitrilehydrochloride;1-benzyl-4-phenyl-4-cyanopiperidine hydrochloric acid salt;1-Benzyl-4-phenyl-4-piperidinecarbonitrile hydrochloride (1:1);1-BENZYL-4-PHENYL-PIPERIDINE-4-CARBONITRILE, HYDROCHLORIDE;4-phenyl-1-(phenylmethyl)-4-piperidinecarbonitrile monohydrochloride;4-phenyl-1-(phenylmethyl)-4-piperidinecarbonitrile monohyrochloride

Chemical Property of 1-Benzyl-4-cyano-4-phenylpiperidine Hydrochloride

Chemical Property:

• Vapor Pressure: 1.3E-07mmHg at 25°C
• Melting Point: 257-261 °C
• Boiling Point: 430.4°C at 760 mmHg
• Flash Point: 184.3°C
• PSA: 27.03000
• LogP: 4.48388
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 312.1393264
• Heavy Atom Count: 22
• Complexity: 360

Purity/Quality:

98% ^*data from raw suppliers

1-Benzyl-4-cyano-4-phenylpiperidine Hydrochloride >98.0%(HPLC)(T) ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn,Xi
• Statements: 20/21/22
• Safety Statements: 45

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1CN(CCC1(C#N)C2=CC=CC=C2)CC3=CC=CC=C3.Cl
• Uses: A piperidine derivative as calcium channel blockers.

Technology Process of 1-Benzyl-4-cyano-4-phenylpiperidine Hydrochloride

There total 4 articles about 1-Benzyl-4-cyano-4-phenylpiperidine Hydrochloride 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: 70.0%

N,N-bis(2-chloro-ethyl)-benzenemethanamine (55-51-6) + phenylacetonitrile (140-29-4) + tetra(n-butyl)ammonium hydrogen sulfate → 1-benzyl-4-phenyl-piperidine-4-carbonitrile; hydrochloride (71258-18-9)

Guidance literature:

With sodium hydroxide; In toluene;

Reference yield:

phenylacetonitrile (140-29-4) + N-benzyl-2-chloro-N-(2-chloroethyl)ethanamine hydrochloride (10429-82-0) → 1-benzyl-4-phenyl-piperidine-4-carbonitrile; hydrochloride (71258-18-9)

Guidance literature:

phenylacetonitrile; N-benzyl-2-chloro-N-(2-chloroethyl)ethanamine hydrochloride; With tetra(n-butyl)ammonium hydrogensulfate; sodium hydroxide; at 112 ℃; for 3h;

With hydrogenchloride; In water; Temperature;

Reference yield:

triethyl-hexadecyl-phosphonium; bromide (56022-38-9) + phenylacetonitrile (140-29-4) + N-benzyl-2-chloro-N-(2-chloroethyl)ethanamine hydrochloride (10429-82-0) → 1-benzyl-4-phenyl-piperidine-4-carbonitrile; hydrochloride (71258-18-9)

Guidance literature:

With hydrogenchloride; potassium hydroxide; In methanol; water;

upstream raw materials:

triethyl-hexadecyl-phosphonium; bromide

phenylacetonitrile

N-benzyl-2-chloro-N-(2-chloroethyl)ethanamine hydrochloride

N,N-bis(2-chloro-ethyl)-benzenemethanamine

Downstream raw materials:

1-(phenylmethyl)-4-phenylpiperidine

pethidinic acid

C-(1-methyl-4-phenyl-piperidin-4-yl)-methylamine

1-methyl-4-phenyl-piperidine-4-carbonitrile

Refernces

• 1、 -. "NOVEL HETEROCYCLIC SUBSTITUTED PYRROLIDINE AMIDE DERIVATIVES". . . Retrieved 2008/06/13.
• 2、 -. "Process for preparing N,N-bis(2-hydroxyethyl)benzylamine and N,N-bis(2-chloroethyl)benzylamine". . . Retrieved 2008/06/13.