HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 15527Erstellt: 27. Oktober 2026
1-Butanone, 1-(4-aminophenyl)-
4-AMINOBUTYROPHENONE · p-Aminobutyrophenone · 4’-amino-butyrophenon · 4'-Aminobutyrophenone · PARA-AMINOBUTYROPHENONE · 4'-Aminobutyrophenone98% · Butyrophenone, 4'-amino- · 1-(4-aminophenyl)-1-butanon
https://huagongshe.com/de/chemical/15527
Identifikatoren & physikalische Daten
| CAS No. | 1688-71-7 |
|---|
| Summenformel | C10H13NO |
|---|
| Durchschnittliche Molmasse | 163,22 g/mol |
|---|
| Monoisotopische Masse | 163,09971404 g/mol |
|---|
| SMILES | CCCC(=O)c1ccc(N)cc1 |
|---|
| InChIKey | CYCSOZSEBPZGPC-UHFFFAOYSA-N |
|---|
| PubChem CID | 15527 |
|---|
| EC No. | 670-494-6 |
|---|
| DTXSID | DTXSID4061884 |
|---|
Chemische & physikalische Eigenschaften
| XLogP | 1,7 |
|---|
| Polarare Oberfläche (TPSA) | 43,1 |
|---|
| H-Brücken-Donoren | 1 |
|---|
| H-Brücken-Akzeptoren | 2 |
|---|
| Frei drehbare Bindungen | 3 |
|---|
| Schwere Atome | 12 |
|---|
| Formalladung | 0 |
|---|
| Komplexität | 148 |
|---|
| Schmelzpunkt | 94 °C |
|---|
| Siedepunkt | 290.31°C (rough estimate) |
|---|
| Dichte | 1.0508 (rough estimate) |
|---|
| Brechungsindex | 1.5400 (estimate) |
|---|
| Lagerbedingungen | 2-8°C |
|---|
| pKa (Säurekonstante) | 2.17±0.10(Predicted) |
|---|
| CAS Datenbank | 1688-71-7(CAS DataBase Reference) |
|---|
| EPA chemische Informationen | 1-Butanone, 1-(4-aminophenyl)- (1688-71-7) |
|---|
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]P233, P260, P261, P264, P264+P265, P270, P271, P280, P284, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P342+P316, P362+P364, P403, P403+P233, P405, 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 (50%) |
|---|
| TSCA-Inventar-Status | TSCA listed |
|---|
| Zollcode | 2914390090 |
|---|
| R-Sätze (R) | 36/37/38 |
|---|
| Gefahrensymbole | Xi |
|---|
| hazard_note | Irritant |
|---|
| Sicherheitshinweise (S) | 26-36/37/39 |
|---|
