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HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HRID 541559Erstellt: 25. Oktober 2026

HCID 178478261, Verbindung → Trifluoroacetate

https://huagongshe.com/reaction/541559

Reaktionsgleichung

Beteiligte Stoffe

RolleNameHCIDEinwaage
EduktHCID 178478261HCID 178478261—
KatalysatorPalladiumHCID 23938—
LösungsmittelEthanolHCID 702—
ProduktTrifluoroacetateHCID 8446866,9%
Produkt6-Chloro-2,4,8,22-tetraazatetracyclo[14.3.1.1(3,7).1(9,13)]docosa-1(20),3(22),4,6,9(21),10,12,16,18-nonaene TrifluoroacetateHCID 66897771—

Reaktionsschritte

To a solution of (14Z)-6-chloro-2,4,8,22-tetraazatetracyclo[14.3.1.1(3,7).1(9,13)]docosa-1(20),3(22),4,6,9(21),10,12,14,16,18-decaene trifluoroacetate (21 mg, 0.045 mmol) in ethanol (1 mL) was added 5% palladium on carbon (5 mg) and the mixture was purged and degassed with hydrogen three times. The mixture was stirred for 1 hour with balloon pressure of hydrogen. Filtration through celite and purification by preparative LCMS (pH 2) gave the desired product as a trifluoroacetate salt (1.7 mg, 30%). LCMS for C18H16ClN4 (M+H)+: m/z=323.1. 1H NMR (400 MHz, CD3OD): δ 7.75 (m, 2H), 7.30 (m, 1H), 7.22 (m, 1H), 7.12 (m, 1H), 7.03 (m, 2H), 6.90 (m, 1H), 3.00 (s, 4H).

Herkunft & Nachweise

DOI10.6084/m9.figshare.5104873.v1
PatentnummerUS08871753B2
Quelldatensatzuspto-grants-2014_10
ORD IDord-5e944b03bc7448f8853db8102b68e694
Quellennotizuspto-grants-2014_10