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Methanol → (3-Chloro-4-hydroxy-5-methyl-phenyl)-acetic acid methyl ester

HRID 271156
Notizen
Druckvorschau

Reaktionsgleichung

Reaktionsgleichung von HRID 271156
[Cl:1][C:2]1[CH:3]=[C:4]([CH2:10][C:11]([OH:13])=[O:12])[CH:5]=[C:6]([CH3:9])[C:7]=1[OH:8].S(=O)(=O)(O)O.[CH3:19]O>>[CH3:19][O:12][C:11](=[O:13])[CH2:10][C:4]1[CH:5]=[C:6]([CH3:9])[C:7]([OH:8])=[C:2]([Cl:1])[CH:3]=1
KomponentenReaktionsbedingungenVersuchsvorschriftAufarbeitungQuellen und NachweiseNotizen zur Reaktion

Komponenten

4

Edukt 3

HCID 887MethanolHCID 1118Sulfuric AcidHCID 68441962(3-Chloro-4-hydroxy-5-methyl-phenyl)-acetic acid

Produkt 1

HCID 68444019(3-Chloro-4-hydroxy-5-methyl-phenyl)-acetic acid methyl esterAusbeute 91 %

Reaktionsbedingungen

Temperatur
70 °C

Versuchsvorschrift

A solution of (3-chloro-4-hydroxy-5-methyl-phenyl)-acetic acid (5b) (1.4 g, 6.98 mmol) in methanol (60 mL) was treated with concentrated sulfuric acid (0.5 mL) at room temperature under argon. The reaction mixture was heated to 70° C. for 24 h. At this time, the reaction mixture was concentrated under vacuum. The resulting oil was diluted with ethyl acetate (100 mL). The organics were washed with water (2×50 mL), dried with magnesium sulfate, filtered and concentrated. The resulting residue was purified by column chromatography using silica gel eluted with 10% ethyl acetate in petroleum ether to afford 3-chloro-4-hydroxy-5-methyl-phenyl)-acetic acid methyl ester (6b) (1.36 g, 91%) as a white solid; EI(+)-HRMS m/z calcd for C10H11ClO3 (M+) 214.0397, found 214.0400. Molecular Weight=214.6504; Exact Mass=214.0397

Aufarbeitung

  1. concentrationAt this time, the reaction mixture was concentrated under vacuum
  2. additionThe resulting oil was diluted with ethyl acetate (100 mL)
  3. washThe organics were washed with water (2×50 mL)
  4. dry with materialdried with magnesium sulfate
  5. filtrationfiltered
  6. concentrationconcentrated
  7. customThe resulting residue was purified by column chromatography
  8. washeluted with 10% ethyl acetate in petroleum ether

Quellen und Nachweise

ORD-Eintrag
ord-93ae7110a8ec431ea1a827b73337e5b8
Quelldatensatz
uspto-grants-2008_11
DOI
10.6084/m9.figshare.5104873.v1
Patentnummer
US07452882B2

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