Benzyl (S)-2-(cyanomethyl)piperazine-1-carboxylate

Benzyl (S)-2-(cyanomethyl)piperazine-1-carboxylate Struktur
2158302-01-1
CAS-Nr.
2158302-01-1
Englisch Name:
Benzyl (S)-2-(cyanomethyl)piperazine-1-carboxylate
Synonyma:
(S)-benzyl 2-(cyanomethyl)piperazine-1-carboxylate;Benzyl (S)-2-(cyanomethyl)piperazine-1-carboxylate hydrochloride;Sildenafil Impurity 61 Hydrochloride;Benzyl 2-(cyanomethyl)piperazine-1-carboxylate;Benzyl (S)-2-(Cyanomethyl)piperazine-1-carboxylate;benzyl (2S)-2-(cyanomethyl)piperazine-1-carboxylate;Benzyl ( S )-2-( cyanomethyl ) piperazine - l - carboxylate;1-benzyl 4-(tert-butyl) (S)-2-(cyanomethyl)piperazine-1,4-dicarboxylate;1-Piperazinecarboxylic acid, 2-(cyanomethyl)-, phenylmethyl ester, (2S)-
CBNumber:
CB84800866
Summenformel:
C14H17N3O2
Molgewicht:
259.3
MOL-Datei:
2158302-01-1.mol

Benzyl (S)-2-(cyanomethyl)piperazine-1-carboxylate Eigenschaften

Siedepunkt:
450.9±30.0 °C(Predicted)
Dichte
1.163±0.06 g/cm3(Predicted)
pka
7.69±0.40(Predicted)
InChI
InChI=1S/C14H17N3O2/c15-7-6-13-10-16-8-9-17(13)14(18)19-11-12-4-2-1-3-5-12/h1-5,13,16H,6,8-11H2/t13-/m0/s1
InChIKey
QSKMFYCQRQLYMF-ZDUSSCGKSA-N
SMILES
N1(C(OCC2=CC=CC=C2)=O)CCNC[C@@H]1CC#N

Sicherheit

Benzyl (S)-2-(cyanomethyl)piperazine-1-carboxylate Chemische Eigenschaften,Einsatz,Produktion Methoden

Synthese

To a solution of I-benzyl 4-tert-butyl (2S)-2-(cyanomethyl) piperazine-1,4-dicarboxylate (6.0 g, 1.0 eq) in dioxane (20.8 mL) was added 4.0 M HCl in dioxane (20.8 mL, 5.0 eq). The mixture was stirred at 20 °C for 1 hour. Then NaHCO3 was added to the reaction mixture until pH>7, after which the reaction was concentrated under reduced pressure to remove dioxane. The residue was diluted with H2O (50 mL) and extracted with ethyl acetate (50 mLx3). The combined organic layers were washed with H2O (20 mL), dried over Na2SO4, filtered, and concentrated under reduced pressure to give a residue. The product benzyl (2S)-2- (cyanomethyl) piperazine-1-carboxylate (4.1 g, 95% yield) was obtained as a yellow oil.Benzyl (S)-2-(cyanomethyl)piperazine-1-carboxylate

Benzyl (S)-2-(cyanomethyl)piperazine-1-carboxylate Upstream-Materialien And Downstream Produkte

Upstream-Materialien

Downstream Produkte


Benzyl (S)-2-(cyanomethyl)piperazine-1-carboxylate Anbieter Lieferant Produzent Hersteller Vertrieb Händler.

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  • 1-Piperazinecarboxylic acid, 2-(cyanomethyl)-, phenylmethyl ester, (2S)-
  • Benzyl (S)-2-(Cyanomethyl)piperazine-1-carboxylate
  • 1-benzyl 4-(tert-butyl) (S)-2-(cyanomethyl)piperazine-1,4-dicarboxylate
  • benzyl (2S)-2-(cyanomethyl)piperazine-1-carboxylate
  • Benzyl 2-(cyanomethyl)piperazine-1-carboxylate
  • Benzyl (S)-2-(cyanomethyl)piperazine-1-carboxylate hydrochloride
  • (S)-benzyl 2-(cyanomethyl)piperazine-1-carboxylate
  • Sildenafil Impurity 61 Hydrochloride
  • Benzyl ( S )-2-( cyanomethyl ) piperazine - l - carboxylate
  • 2158302-01-1
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