HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
3-Aminobiphenyl
3-BIPHENYLAMINE · AKOS BAR-2291 · 3-AMINODIPHENYL · 3-AMINOBIPHENYL · m-Phenylaniline · 3-Phenylaniline · M-AMINOBIPHENYL · biphenyl-3-amine
Identifikatoren & physikalische Daten
| CAS No. | 2243-47-2 |
|---|---|
| Summenformel | C12H11N |
| Durchschnittliche Molmasse | 169,22 g/mol |
| Monoisotopische Masse | 169,08914935 g/mol |
| SMILES | Nc1cccc(-c2ccccc2)c1 |
| InChIKey | MUNOBADFTHUUFG-UHFFFAOYSA-N |
| PubChem CID | 16717 |
| ChEMBL | CHEMBL1642684 |
| EC No. | 675-679-5 |
| DTXSID | DTXSID2036825 |
Chemische & physikalische Eigenschaften
| XLogP | 3,3 |
|---|---|
| Polarare Oberfläche (TPSA) | 26 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 1 |
| Frei drehbare Bindungen | 1 |
| Schwere Atome | 13 |
| Formalladung | 0 |
| Komplexität | 149 |
| SpringerMaterials Properties | 13C nuclear magnetic resonance spectrum |
| Schmelzpunkt | 28-33 °C |
| Siedepunkt | 125/1mm |
| Dichte | 1.0788 (rough estimate) |
| Brechungsindex | 1.6125 (estimate) |
| Flammpunkt | 29 °C |
| Lagerbedingungen | Keep in dark place,Inert atmosphere,Room temperature |
| Löslichkeit | soluble in Methanol |
| Aggregatzustand | powder to lump to clear liquid |
| pKa (Säurekonstante) | 4.25(at 18℃) |
| Farbe | White or Colorless to Light orange to Yellow |
| InChI | 1S/C12H11N/c13-12-8-4-7-11(9-12)10-5-2-1-3-6-10/h1-9H,13H2 |
| InChIKey | MUNOBADFTHUUFG-UHFFFAOYSA-N |
| SMILES | Nc1cccc(c1)-c2ccccc2 |
| CAS Datenbank | 2243-47-2(CAS DataBase Reference) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (97.6%): 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 42 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Acute Tox. 4 (97.6%) |
| Carcinogen Classification | Not listed by IARC. |
| Wassergefährdungsklasse (WGK) | 3 |
| UN-Transportnummer | UN2811 |
| Zollcode | 29029090 |
| RTECS-Nr. | DU8900000 |
| R-Sätze (R) | 20/21/22-36/37/38-51-22 |
| Gefahrensymbole | Xi,Xn,N |
| hazard_note | Irritant |
| Sicherheitshinweise (S) | 26-36/37/39-36-61-45-25-24 |
| Gefahrenklasse | 6.1Acute Tox. 4 OralEye Irrit. 2Skin Irrit. 2STOT SE 3 |
| Verpackungsgruppe | III |
| Lagerklasse | 11 - Combustible Solids |
Anwendungen & Verwendung
Verwenden
Product of smoking tobacco