HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 84759Erstellt: 27. Oktober 2026
4-Aminoquinazoline
quinazolin-4-amine · NSC 288012 · 4-QUINAZOLINAMINE · Quizolin-4-ylamine · 4-QUINAZOLINEAMINE · Quinazoline-4-amine · 4-QUINAZOLINYLAMINE · 4-AMINOQUINAZOLINE
https://huagongshe.com/de/chemical/84759
Identifikatoren & physikalische Daten
| CAS No. | 15018-66-3 |
|---|
| Summenformel | C8H7N3 |
|---|
| Durchschnittliche Molmasse | 145,16 g/mol |
|---|
| Monoisotopische Masse | 145,06399722 g/mol |
|---|
| SMILES | Nc1ncnc2ccccc12 |
|---|
| InChIKey | DRYRBWIFRVMRPV-UHFFFAOYSA-N |
|---|
| PubChem CID | 84759 |
|---|
| ChEMBL | CHEMBL266128 |
|---|
| EC No. | 675-065-7 |
|---|
| DTXSID | DTXSID90164488 |
|---|
Chemische & physikalische Eigenschaften
| XLogP | 1,3 |
|---|
| Polarare Oberfläche (TPSA) | 51,8 |
|---|
| H-Brücken-Donoren | 1 |
|---|
| H-Brücken-Akzeptoren | 3 |
|---|
| Frei drehbare Bindungen | 0 |
|---|
| Schwere Atome | 11 |
|---|
| Formalladung | 0 |
|---|
| Komplexität | 137 |
|---|
| LogP (Verteilungskoeffizient) | 1.28 |
|---|
| Schmelzpunkt | 274-275℃ |
|---|
| Siedepunkt | 328.3±17.0 °C(Predicted) |
|---|
| Dichte | 1.292±0.06 g/cm3(Predicted) |
|---|
| Lagerbedingungen | Keep in dark place,Inert atmosphere,Room temperature |
|---|
| Aggregatzustand | Solid |
|---|
| pKa (Säurekonstante) | 5.86±0.30(Predicted) |
|---|
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (80%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 5 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|
| Hazard Classes and Categories | Acute Tox. 4 (80%) |
|---|
| UN-Transportnummer | 2811 |
|---|
| Zollcode | 2933998090 |
|---|
| R-Sätze (R) | 41 |
|---|
| Sicherheitshinweise (S) | 26-39 |
|---|
| Gefahrenklasse | IRRITANT |
|---|
| Verpackungsgruppe | Ⅲ |
|---|
