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HCID 2773439Erstellt: 26. Oktober 2026

Ethyl 3-amino-1H-pyrrole-2-carboxylate

2-Ethoxycarbonyl-3-aminopyrrole · 252932-48-2 · 3-Amino-1H-pyrrole-2-carboxylic acid ethyl ester · 1H-Pyrrole-2-carboxylic acid, 3-amino-, ethyl ester · 1H-Pyrrole-2-carboxylicacid,3-amino-,ethylester(9CI)

https://huagongshe.com/de/chemical/2773439

Molekülstruktur von Ethyl 3-amino-1H-pyrrole-2-carboxylate

Identifikatoren & physikalische Daten

CAS No.252932-48-2
SummenformelC7H10N2O2
Durchschnittliche Molmasse154,17 g/mol
Monoisotopische Masse154,07422756 g/mol
SMILESCCOC(=O)c1[nH]ccc1N
InChIKeySPNDLEQTZLQLTA-UHFFFAOYSA-N
PubChem CID2773439
EC No.631-037-6
DTXSIDDTXSID70378460

Chemische & physikalische Eigenschaften

XLogP1,1
Polarare Oberfläche (TPSA)68,1
H-Brücken-Donoren2
H-Brücken-Akzeptoren3
Frei drehbare Bindungen3
Schwere Atome11
Formalladung0
Komplexität149
Siedepunkt310.9±22.0 °C(Predicted)
Dichte1.238±0.06 g/cm3(Predicted)
Lagerbedingungenunder inert gas (nitrogen or Argon) at 2–8 °C
pKa (Säurekonstante)15.93±0.50(Predicted)
InChIInChI=1S/C7H10N2O2/c1-2-11-7(10)6-5(8)3-4-9-6/h3-4,9H,2,8H2,1H3
InChIKeySPNDLEQTZLQLTA-UHFFFAOYSA-N
SMILESN1C=CC(N)=C1C(OCC)=O

Sicherheit & Vorschriften

GHS-EinstufungWarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P264, P280, P302+P352, P321, P332+P317, and P362+P364 (click each P-code to see the statement)Aggregated GHS information provided per 40 reports by companies from 1 notifications to the ECHA C&L Inventory.DangerH318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
Regulatorische Informationen1H-Pyrrole-2-carboxylic acid, 3-amino-, ethyl ester: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesSkin Irrit. 2 (100%)Eye Dam. 1 (100%)
GefahrenklasseIRRITANT

Anwendungen & Verwendung

Verwenden

Ethyl 3-amino-1H-pyrrole-2-carboxylate