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Bromine → Methyl 4-(2-amino-2-oxoethoxy)-5-bromo-2-methoxybenzoate

HRID 1671961
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Druckvorschau

Reaktionsgleichung

Reaktionsgleichung von HRID 1671961
[NH2:1][C:2](=[O:17])[CH2:3][O:4][C:5]1[CH:14]=[CH:13][C:8]([C:9]([O:11][CH3:12])=[O:10])=[C:7]([O:15][CH3:16])[CH:6]=1.[Br:18]Br>C(Cl)(Cl)Cl>[NH2:1][C:2](=[O:17])[CH2:3][O:4][C:5]1[C:14]([Br:18])=[CH:13][C:8]([C:9]([O:11][CH3:12])=[O:10])=[C:7]([O:15][CH3:16])[CH:6]=1
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Komponenten

4

Edukt 2

HCID 24408BromineHCID 67211435Methyl 4-(2-amino-2-oxoethoxy)-2-methoxybenzoate

Produkt 1

HCID 67210885Methyl 4-(2-amino-2-oxoethoxy)-5-bromo-2-methoxybenzoateAusbeute 104 %

Reagenzien, Katalysatoren, Lösungsmittel 1

HCID 6212ChloroformLösungsmittel2×

Reaktionsbedingungen

Temperatur
0 °C

Versuchsvorschrift

To a 250 mL round-bottomed flask was added methyl 4-(2-amino-2-oxoethoxy)-2-methoxybenzoate (1.2 g, 5.14 mmol) and chloroform (40 mL). The mixture was placed under a nitrogen atmosphere and cooled to 0° C. Bromine (0.263 mL, 5.14 mmol) was added drop wise (in 3 mL of chloroform) and the solution was allowed to warm to room temperature overnight. The orange solid was cooled with an ice bath, filtered, washed sequentially with cold chloroform, then diethyl ether. The product was dried under vacuum giving 1.7 grams (91% yield) of methyl 4-(2-amino-2-oxoethoxy)-5-bromo-2-methoxybenzoate as an orange solid. The LC/MS data was obtained on a Shimadzu analytical LC/Micromass Platform LC (ESI+) at 220 nm using the following set of conditions: Waters Sunfire 5 μm C18, 4.6×30 mm column, with a gradient of 0-100% B (B=90% HPLC grade methanol/0.1% trifluoroacetic acid/10% HPLC grade water), (A=90% HPLC grade water/0.1% trifluoroacetic acid/10% HPLC grade methanol), in 2 minutes with a 1 minute hold at a rate of 4 mL/minute. 1H NMR (400 MHz, THF-d8) δ ppm 3.76 (s, 3H), 3.88 (s, 3H), 4.63 (s, 2H), 6.76 (s, 1H), 7.10 (br. s., 2H), 7.96 (s, 1H). LCMS Rt=1.793 min., m/z 319.1 (M+H), 90% purity.

Aufarbeitung

  1. temperatureto warm to room temperature overnight
  2. temperatureThe orange solid was cooled with an ice bath
  3. filtrationfiltered
  4. washwashed sequentially with cold chloroform
  5. customThe product was dried under vacuum

Quellen und Nachweise

ORD-Eintrag
ord-d999b5a8fc284e54a1eb6ce91df2e6b9
Quelldatensatz
uspto-grants-2011_08
DOI
10.6084/m9.figshare.5104873.v1
Patentnummer
US07994171B2

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