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HCID 7164639Erstellt: 26. Oktober 2026

tert-Butyl 4-(5-iodopyridin-2-yl)piperazine-1-carboxylate

1-BOC-4-(5-IODOPYRIDIN-2-YL)PIPERAZINE · 4-(5-IODOPYRID-2-YL)PIPERAZINE, 1-BOC PROTECTED · 4-(5-Iodopyridin-2-yl)piperazine, N1-BOC protected · 4-(5-Iodopyridin-2-yl)piperazine,N1-BOCprotected97% · 4-(5-Iodopyridin-2-yl)piperazine, N1-BOC protected 97% · tert-Butyl 4-(5-iodopyrid-2-yl)piperazine-1-carboxylate · TERT-BUTYL 4-(5-IODOPYRIDIN-2-YL)PIPERAZINE-1-CARBOXYLATE · 4-(5-iodo-2-pyridinyl)-1-piperazinecarboxylic acid tert-butyl ester

https://huagongshe.com/de/chemical/7164639

Molekülstruktur von tert-Butyl 4-(5-iodopyridin-2-yl)piperazine-1-carboxylate

Identifikatoren & physikalische Daten

CAS No.497915-42-1
SummenformelC14H20IN3O2
Durchschnittliche Molmasse389,23 g/mol
Monoisotopische Masse389,06002488 g/mol
SMILESCC(C)(C)OC(=O)N1CCN(c2ccc(I)cn2)CC1
InChIKeyRJHWOWJRQNENIC-UHFFFAOYSA-N
PubChem CID7164639
EC No.676-454-4
DTXSIDDTXSID70428212

Chemische & physikalische Eigenschaften

XLogP2,6
Polarare Oberfläche (TPSA)45,7
H-Brücken-Donoren0
H-Brücken-Akzeptoren4
Frei drehbare Bindungen3
Schwere Atome20
Formalladung0
Komplexität338
Schmelzpunkt102 °C
Siedepunkt457.5±45.0 °C(Predicted)
Dichte1.524±0.06 g/cm3(Predicted)
pKa (Säurekonstante)6.40±0.29(Predicted)

Sicherheit & Vorschriften

GHS-EinstufungWarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 4 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Zollcode2933599590
R-Sätze (R)25
GefahrensymboleXi,T
hazard_noteIrritant
Sicherheitshinweise (S)45