1-(3-(p-tert-Butylbenzoyl)propyl)-4-(hydroxybenzhydryl)piperidinium chloride

Base Information

• Chemical Name: 1-(3-(p-tert-Butylbenzoyl)propyl)-4-(hydroxybenzhydryl)piperidinium chloride
• CAS No.: 43076-44-4
• Molecular Formula: C₃₂H₃₉NO₂*ClH
• Molecular Weight: 506.128
• European Community (EC) Number: 256-075-7
• Mol file: 43076-44-4.mol

Synonyms:43076-44-4;EINECS 256-075-7;1-(3-(p-tert-Butylbenzoyl)propyl)-4-(hydroxybenzhydryl)piperidinium chloride;Butyrophenone, 4'-tert-butyl-4-(4-(diphenylhydroxymethyl)piperidino)-, hydrochloride;1-[3-(p-tert-butylbenzoyl)propyl]-4-(hydroxybenzhydryl)piperidinium chloride;4'-tert-Butyl-4-(4-(diphenylhydroxymethyl)piperidino)butyrophenone hydrochloride;C32H39NO2.ClH;C32-H39-N-O2.Cl-H;LS-48296;FT-0623324;1-[3-(p-tert-butylbenzoyl)propyl]-4-(hydroxybenzhydryl)piperidiniumchloride

Chemical Property of 1-(3-(p-tert-Butylbenzoyl)propyl)-4-(hydroxybenzhydryl)piperidinium chloride

Chemical Property:

• Vapor Pressure: 1.85E-16mmHg at 25°C
• Melting Point: 234-235 °C
• Boiling Point: 624.5°Cat760mmHg
• Flash Point: 331.5°C
• PSA: 40.54000
• Density: g/cm³
• LogP: 7.33500
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 9
• Exact Mass: 505.2747572
• Heavy Atom Count: 36
• Complexity: 621

Purity/Quality:

98%Min ^*data from raw suppliers

4'-TERT-BUTYL-4-(4-(DIPHENYLHYDROXYMETHYL)PIPERIDINO)BUTYROPHENONE HYDROCHLORIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)C1=CC=C(C=C1)C(=O)CCC[NH+]2CCC(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O.[Cl-]

Technology Process of 1-(3-(p-tert-Butylbenzoyl)propyl)-4-(hydroxybenzhydryl)piperidinium chloride

There total 2 articles about 1-(3-(p-tert-Butylbenzoyl)propyl)-4-(hydroxybenzhydryl)piperidinium chloride 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: 24.0%

C18H21NO (115-46-8) + 4'-tert-butyl-4-chlorobutyrophenone (43076-61-5) → 1-<4-(1,1-Dimethylethyl)phenyl>-4-<4-(hydroxydiphenylmethyl)-1-piperidinyl>-1-butanone Hydrochloride (43076-44-4)

Guidance literature:

With hydrogenchloride; potassium hydrogencarbonate; In toluene; for 60h; Heating;

Reference yield:

→ 1-<4-(1,1-Dimethylethyl)phenyl>-4-<4-(hydroxydiphenylmethyl)-1-piperidinyl>-1-butanone Hydrochloride (43076-44-4)

Guidance literature:

upstream raw materials:

C₁₈H₂₁NO

4'-tert-butyl-4-chlorobutyrophenone

Refernces

• 1、 -. "Compositions and methods for the treatment of the symptoms of histamine induced allergic reactions". . . Retrieved 2008/06/13.