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Cyanamide → 5-tert-Butyl-1,3-thiazol-2-amine

HRID 78462
Notizen
Druckvorschau

Reaktionsgleichung

Reaktionsgleichung von HRID 78462
[CH3:1][C:2]([CH3:7])([CH3:6])[CH2:3][CH:4]=O.N1CCCC1.O.C1(C)C=CC([S:20](O)(=O)=O)=CC=1.[S].[N:26]#[C:27][NH2:28]>C1CCCCC1.CO>[C:2]([C:3]1[S:20][C:27]([NH2:28])=[N:26][CH:4]=1)([CH3:7])([CH3:6])[CH3:1]
KomponentenReaktionsbedingungenVersuchsvorschriftAufarbeitungQuellen und NachweiseNotizen zur Reaktion

Komponenten

8

Edukt 5

HCID 9864CyanamideHCID 31268PyrrolidineHCID 763353,3-DimethylbutanalHCID 521998p-Toluenesulfonic acid monohydrateHCID 5362487Sulfur

Produkt 1

HCID 6764855-tert-Butyl-1,3-thiazol-2-amine

Reagenzien, Katalysatoren, Lösungsmittel 2

HCID 887
Methanol
Lösungsmittel
HCID 8078CyclohexaneLösungsmittel

Reaktionsbedingungen

Temperatur
0 °C

Versuchsvorschrift

To a flask equipped with a Dean-Stark trap was added 3,3-dimethylbutanal (Aldrich, 5.0 g, 50 mmol), pyrrolidine (Aldrich, 4.4 mL, 52 mmol) and p-toluenesulfonic acid monohydrate (10 mg) in cyclohexane (70 mL). The mixture was heated to reflux for 3 hours, the water was removed and the organic phase was concentrated under reduced pressure. The residue was dissolved in methanol (20 mL) and cooled to 0° C. Sulfur (Aldrich, 1.6 g, 50 mmol) and a solution of cyanamide (Aldrich, 2.1 g, 50 mmol) in methanol (5 mL) were added. The reaction mixture was allowed to warm to ambient temperature, stirred for 12 hours, and was concentrated under reduced pressure. The residue was purified by column chromatography (SiO2, 2% methanol in CH2Cl2) to afford the title compound. MS (ESI+) m/z 157 (M+H)+.

Aufarbeitung

  1. customTo a flask equipped with a Dean-Stark trap
  2. temperatureThe mixture was heated
  3. temperatureto reflux for 3 hours
  4. customthe water was removed
  5. concentrationthe organic phase was concentrated under reduced pressure
  6. dissolutionThe residue was dissolved in methanol (20 mL)
  7. temperatureto warm to ambient temperature
  8. concentrationwas concentrated under reduced pressure
  9. customThe residue was purified by column chromatography (SiO2, 2% methanol in CH2Cl2)

Quellen und Nachweise

ORD-Eintrag
ord-442afd61994841d090b441f168f90dc6
Quelldatensatz
uspto-grants-2014_09
DOI
10.6084/m9.figshare.5104873.v1
Patentnummer
US08841334B2

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