Cambridge id 5314153

Base Information

• Chemical Name: Cambridge id 5314153
• CAS No.: 886-06-6
• Molecular Formula: C14H19 N O . Cl H
• Molecular Weight: 253.772
• Hs Code.: 2933399090
• Mol file: 886-06-6.mol

Synonyms:SMR000136964;Cambridge id 5314153;MLS000532022;HMS2461B13;CCG-5897;AKOS003614698;BIM-0016908.P001

Chemical Property of Cambridge id 5314153

Chemical Property:

• Vapor Pressure: 6.19E-05mmHg at 25°C
• Melting Point: 192-193 °C(Solv: ethanol (64-17-5); acetone (67-64-1))
• Boiling Point: 345.4°C at 760 mmHg
• Flash Point: 127.1°C
• PSA: 20.31000
• Density: 1.029g/cm³
• LogP: 3.48520
• Storage Temp.: Sealed in dry,Room Temperature
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 253.1233420
• Heavy Atom Count: 17
• Complexity: 215

Purity/Quality:

99.9% ^*data from raw suppliers

3-PIPERIDINOPROPIOPHENONE HYDROCHLORIDE ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1CC[NH+](CC1)CCC(=O)C2=CC=CC=C2.[Cl-]
• Uses: 3-Piperidinopropiophenone is a mono Mannich base derived from acetophenone with antibacterial, antifungal and antitumor activity. 3-Piperidinopropiophenone shows cytotoxicity againts Jurkat cells.

Technology Process of Cambridge id 5314153

There total 7 articles about Cambridge id 5314153 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: 81.0%

formaldehyd (50-00-0,30525-89-4,61233-19-0) + piperidine hydrochloride (6091-44-7) + acetophenone (98-86-2) → 1-phenyl-3-piperidino-propan-1-one; hydrochloride (886-06-6)

Guidance literature:

In ethanol; for 3h; Heating;

Reference yield: 80.0%

1,3,5-Trioxan (110-88-3) + piperidine hydrochloride (6091-44-7) + acetophenone (98-86-2) → 1-phenyl-3-piperidino-propan-1-one; hydrochloride (886-06-6)

Guidance literature:

With water; for 0.0125h; combined microwave and ultrasound irradiation;

DOI:10.1055/s-2005-872246

Reference yield: 22.0%

piperidine (110-89-4) + 1-Phenyl-2-propyn-1-ol (4187-87-5) → 1-phenyl-3-piperidino-propan-1-one; hydrochloride (886-06-6)

Guidance literature:

With potassium hydroxide; In ethanol; for 24h; Ambient temperature;

upstream raw materials:

piperidine

3-(dimethylamino)propiophenone hydrochloride

1-Phenyl-2-propyn-1-ol

formaldehyd

Downstream raw materials:

1-phenyl-3-piperidino-propane-1,2-dione-2-oxime

1,3-Dimethyl-2,4-dioxo-7-phenyl-1,2,3,4-tetrahydro-pyrido<2,3-d>pyrimidin

4-phenyl-5-piperidinomethyl-thiazol-2-ylamine

7-phenyl-2-phenylamino-pyrazolo[1,5-a]pyrimidine-3-carboxylic acid (3-carbamoyl-4,5,6,7-tetrahydro-benzo[b]thiophen-2-yl)-amide

Refernces

• 1、 Rui, Marta,Rossino, Giacomo,Coniglio, Stefania,Monteleone, Stefania,Scuteri, Arianna,Malacrida, Alessio,Rossi, Daniela,Catenacci, Laura,Sorrenti, Milena,Paolillo, Mayra,Curti, Daniela,Venturini, Letizia,Schepmann, Dirk,Wünsch, Bernhard,Liedl, Klaus R.,Cavaletti, Guido,Pace, Vittorio,Urban, Ernst,Collina, Simona. "Identification of dual Sigma1 receptor modulators/acetylcholinesterase inhibitors with antioxidant and neurotrophic properties, as neuroprotective agents". . p. 353 - 370. Retrieved 2018/09/21.
• 2、 Unluer, Elif,Gul, Halise Inci,Demirtas, Alkan,Sakagami, Hiroshi,Umemura, Naoki,Tanc, Muhammet,Kazaz, Cavit,Supuran, Claudiu T.. "Synthesis and bioactivity studies of 1-aryl-3-(2-hydroxyethylthio)-1-propanones". . p. 105 - 109. Retrieved 2016/12/16.