HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 650402Erstellt: 26. Oktober 2026
Piperazin-1-yl-acetic acid
2-(PIPERAZIN-1-YL)ACETIC ACID · AKOS BB-5495 · TIMTEC-BB SBB010118 · IFLAB-BB F1929-1681 · 1-PIPERAZINYLACETIC ACID · PIPERAZIN-1-YL-ACETIC ACID · 1-Piperazineacetic acid 2HCl · piperazinediium-1-yl acetate
https://huagongshe.com/de/chemical/650402
Identifikatoren & physikalische Daten
| CAS No. | 37478-58-3 |
|---|
| Summenformel | C6H12N2O2 |
|---|
| Durchschnittliche Molmasse | 144,17 g/mol |
|---|
| Monoisotopische Masse | 144,08987762 g/mol |
|---|
| SMILES | O=C(O)CN1CCNCC1 |
|---|
| InChIKey | WRJZKSHNBALIGH-UHFFFAOYSA-N |
|---|
| PubChem CID | 650402 |
|---|
| ChEMBL | CHEMBL1451367 |
|---|
| EC No. | 671-465-0 |
|---|
| DTXSID | DTXSID00349502 |
|---|
Chemische & physikalische Eigenschaften
| XLogP | -3,1 |
|---|
| Polarare Oberfläche (TPSA) | 52,6 |
|---|
| H-Brücken-Donoren | 2 |
|---|
| H-Brücken-Akzeptoren | 4 |
|---|
| Frei drehbare Bindungen | 2 |
|---|
| Schwere Atome | 10 |
|---|
| Formalladung | 0 |
|---|
| Komplexität | 121 |
|---|
| Schmelzpunkt | >220°C |
|---|
| Siedepunkt | 292.6±25.0 °C(Predicted) |
|---|
| Dichte | 1.146±0.06 g/cm3(Predicted) |
|---|
| Lagerbedingungen | Sealed in dry,Room Temperature |
|---|
| pKa (Säurekonstante) | 1.85±0.10(Predicted) |
|---|
| CAS Datenbank | 37478-58-3(CAS DataBase Reference) |
|---|
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|
| Hazard Classes and Categories | Acute Tox. 4 (100%) |
|---|
| Zollcode | 2933599590 |
|---|
| Gefahrensymbole | Xi |
|---|
| hazard_note | Irritant |
|---|
