1-Benzyl-3-piperidone hydrochloride Chemical Properties

Melting point:

170 °C

Boiling point:

91°C/0.02mmHg(lit.)

storage temp. 

Inert atmosphere,Room Temperature

form 

Powder

color 

Cream to pale brown

BRN 

3705146

InChI

1S/C12H15NO.ClH.H2O/c14-12-7-4-8-13(10-12)9-11-5-2-1-3-6-11;;/h1-3,5-6H,4,7-10H2;1H;1H2

InChIKey

XDAGZUGDGORLMZ-UHFFFAOYSA-N

SMILES

Cl[H].[H]O[H].O=C1CCCN(C1)Cc2ccccc2

CAS DataBase Reference

50606-58-1(CAS DataBase Reference)

Safety Information

Hazard Codes 

Xn

Risk Statements 

36/37/38-20/21/22

Safety Statements 

22-24/25-37/39-36-26

WGK Germany 

3

F 

10

HS Code 

29333990

Storage Class

11 - Combustible Solids

MSDS

• Language:English Provider:1-Benzyl-3-piperidone hydrochloride
• Language:English Provider:SigmaAldrich
• Language:English Provider:ACROS
• Language:English Provider:ALFA

1-Benzyl-3-piperidone hydrochloride Usage And Synthesis

Chemical Properties

cream to pale brown powder

Uses

1-Benzyl-3-piperidone hydrochloride hydrate was used to prepare 7-Benzyl-3-(phenylthio)-1-oxa-4,7-diazaspiro[4.5]dec-3-en-2-one.

Synthesis

Piperidone hydrochloride, potassium carbonate, potassium iodide and triethylbenzylammonium chloride, benzyl bromide to the three reaction flask, add water and toluene, reflux, stirring reaction, thin-layer chromatography to detect the endpoints ??Expanding agent: V (cyclohexane)??V (ethyl acetate)??, the reaction is 11 ~ 12h. cooled to room temperature, separated out the organic layer, toluene to extract the aqueous layer, the combination of the organic layer, saturated sodium bicarbonate solution and water to wash, dry anhydrous sodium sulfate. Dry with anhydrous sodium sulfate, evaporate the toluene, dry to a white solid, the crude product was recrystallized with anhydrous ethanol to obtain a white to off-white powder 1-benzyl-3-piperidone hydrochloride.

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