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HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HRID 1014866Erstellt: 25. Oktober 2026

Butyl nitrite → 3-(Dipropylcarbamoyl)benzoic acid

https://huagongshe.com/reaction/1014866

Reaktionsgleichung

Beteiligte Stoffe

RolleNameHCIDEinwaage
EduktButyl nitriteHCID 10996—
EduktN-Boc-cis-4-hydroxy-D-prolineHCID 688616—
Edukt3-Bromo-5-(methoxycarbonyl)benzoic acidHCID 22593641—
Edukt(4R)-1-Boc-4-(2-propen-1-yloxy)-D-prolineHCID 67315699—
KatalysatorCopper bromide (CuBr2)HCID 24611—
LösungsmittelWaterHCID 962—
LösungsmittelAcetonitrileHCID 6342—
Produkt3-(Dipropylcarbamoyl)benzoic acidHCID 18276997%

Reaktionsschritte

Step G (2): 3-bromo-5-(methoxycarbonyl)benzoic acid. To a mixture of copper (II) bromide (5.5 g, 24.6 mmol), n-butyl nitrite (3.17 g, 30.75 mmol) and acetonitrile (300 mL) was added 3-amino-5-(methoxycarbonyl)benzoic acid (Step G (1), 4.0 g, 20.5 mmol) in aceonitrile (300 mL) over 30 min at 0° C. and the mixture was warmed up and stirred at rt for 3 h. H2O was added and acetonitrile was removed. Ethyl acetate (600 mL) was added and the mixture was washed with 3N HCl, H2O, dried over Na2SO4, and concentrated in vacuo to give the title compound (97% yield): 1H NMR (CDCl3, 500 MHz) δ ppm 3.96 (3H, s), 8.41 (1H, s), 8.41 (1H, s), 8.67 (1H, m). MS (ESI) (M−H)− 259.02.

Herkunft & Nachweise

DOI10.6084/m9.figshare.5104873.v1
PatentnummerUS07981913B2
Quelldatensatzuspto-grants-2011_07
ORD IDord-7e4cf51a9ccc4cd58d94b5cebc37a06a
Quellennotizuspto-grants-2011_07