HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 522787Erstellt: 25. Oktober 2026
3-Amino-5-tert-butylpyrazole
5-tert-Butyl-1H-pyrazol-3-amine · BUTTPARK 30\09-75 · IFLAB-BB F2108-0129 · 5-AMINO-3-T-BUTYLPYRAZOLE · 3-Amino-5-tert-butylpyrazol · 3-AMino-5-Tert-Butylpyarzole · 3-AMINO-5-TERT-BUTYLPYRAZOLE · 5-AMINO-3-TERT-BUTYLPYRAZOLE
https://huagongshe.com/de/chemical/522787
Identifikatoren & physikalische Daten
| CAS No. | 82560-12-1 |
|---|
| Summenformel | C7H13N3 |
|---|
| Durchschnittliche Molmasse | 139,2 g/mol |
|---|
| Monoisotopische Masse | 139,11094742 g/mol |
|---|
| SMILES | CC(C)(C)c1cc(N)n[nH]1 |
|---|
| InChIKey | ZHBXGHWSVIBUCQ-UHFFFAOYSA-N |
|---|
| PubChem CID | 522787 |
|---|
| EC No. | 450-360-1 |
|---|
| DTXSID | DTXSID60335062 |
|---|
Chemische & physikalische Eigenschaften
| XLogP | 1,6 |
|---|
| Polarare Oberfläche (TPSA) | 54,7 |
|---|
| H-Brücken-Donoren | 2 |
|---|
| H-Brücken-Akzeptoren | 2 |
|---|
| Frei drehbare Bindungen | 1 |
|---|
| Schwere Atome | 10 |
|---|
| Formalladung | 0 |
|---|
| Komplexität | 117 |
|---|
| Schmelzpunkt | 60 °C |
|---|
| Siedepunkt | 302.1±30.0 °C(Predicted) |
|---|
| Dichte | 1.071±0.06 g/cm3(Predicted) |
|---|
| Lagerbedingungen | Keep in dark place,Sealed in dry,Room Temperature |
|---|
| Löslichkeit | soluble in Methanol |
|---|
| Aggregatzustand | powder to crystalline |
|---|
| pKa (Säurekonstante) | 16.08±0.10(Predicted) |
|---|
| Farbe | White to Brown |
|---|
| InChI | 1S/C7H13N3/c1-7(2,3)5-4-6(8)10-9-5/h4H,1-3H3,(H3,8,9,10) |
|---|
| InChIKey | ZHBXGHWSVIBUCQ-UHFFFAOYSA-N |
|---|
| SMILES | CC(C)(C)c1cc(N)n[nH]1 |
|---|
| CAS Datenbank | 82560-12-1(CAS DataBase Reference) |
|---|
| EPA chemische Informationen | 1H-Pyrazol-3-amine, 5-(1,1-dimethylethyl)- (82560-12-1) |
|---|
Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 44.6% (37 of 83) of reports.WarningH302 (45.8%): Harmful if swallowed [Warning Acute toxicity, oral]P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 83 reports by companies from 6 notifications to the ECHA C&L Inventory.Danger |
|---|
| Regulatorische Informationen | Status: Active Update: 10-11-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/9035Status: Active Update: 03-09-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/26373 |
|---|
| Hazard Classes and Categories | Skin Irrit. 2 (100%)Acute Tox. 4 (45.8%) |
|---|
| Wassergefährdungsklasse (WGK) | 3 |
|---|
| Zollcode | 2933199090 |
|---|
| R-Sätze (R) | 22 |
|---|
| Gefahrensymbole | Xi,Xn |
|---|
| Sicherheitshinweise (S) | 24/25 |
|---|
| Lagerklasse | 11 - Combustible Solids |
|---|
