Identifikatoren & physikalische Daten
| CAS No. | 108-37-2 |
|---|
| Summenformel | C6H4BrCl |
|---|
| Durchschnittliche Molmasse | 191,45 g/mol |
|---|
| Monoisotopische Masse | 189,91848991 g/mol |
|---|
| SMILES | Clc1cccc(Br)c1 |
|---|
| InChIKey | JRGGUPZKKTVKOV-UHFFFAOYSA-N |
|---|
| PubChem CID | 7928 |
|---|
| EC No. | 203-575-8 |
|---|
| DTXSID | DTXSID6059360 |
|---|
Chemische & physikalische Eigenschaften
| XLogP | 3,7 |
|---|
| Polarare Oberfläche (TPSA) | 0 |
|---|
| H-Brücken-Donoren | 0 |
|---|
| H-Brücken-Akzeptoren | 0 |
|---|
| Frei drehbare Bindungen | 0 |
|---|
| Schwere Atome | 8 |
|---|
| Formalladung | 0 |
|---|
| Komplexität | 74,9 |
|---|
| SpringerMaterials Properties | 13C nuclear magnetic resonance spectrum |
|---|
| LogP (Verteilungskoeffizient) | 3.83 |
|---|
| Dichte | 1.6302 @ 20°C1.63844 g/cm3(Temp: 15.00 °C) |
|---|
| Siedepunkt | 196 °C @760 [mm Hg] |
|---|
| Schmelzpunkt | -21.5 °C |
|---|
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315 (96.4%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 55 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|
| Regulatorische Informationen | 1-Bromo-3-chlorobenzene: Does not have an individual approval but may be used under an appropriate group standard |
|---|
| Hazard Classes and Categories | Skin Irrit. 2 (96.4%) |
|---|
| Protective Action Criteria (PAC) | 12 [mg/m3]130 [mg/m3]790 [mg/m3] |
|---|
| Alarmwort | Warnung |
|---|
| Gefahrenhinweise | Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H315 |
|---|