HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
5-Bromoquinoline
5-BromoquinoL · 5-BROMOQUINOLINE · 5-bronoquinoline · 5-bromooquinoline · RARECHEM AK ML 0010 · Quinoline, 5-bromo- · 5-Bromoquinoline >5-Bromoquinoline,97% · 5-Bromoquinoline 97%
Identifikatoren & physikalische Daten
| CAS No. | 4964-71-0 |
|---|---|
| Summenformel | C9H6BrN |
| Durchschnittliche Molmasse | 208,05 g/mol |
| Monoisotopische Masse | 206,96836129 g/mol |
| SMILES | Brc1cccc2ncccc12 |
| InChIKey | CHODTZCXWXCALP-UHFFFAOYSA-N |
| PubChem CID | 817321 |
| EC No. | 639-373-5 |
| DTXSID | DTXSID10355790 |
Chemische & physikalische Eigenschaften
| XLogP | 3,3 |
|---|---|
| Polarare Oberfläche (TPSA) | 12,9 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 1 |
| Frei drehbare Bindungen | 0 |
| Schwere Atome | 11 |
| Formalladung | 0 |
| Komplexität | 138 |
| Schmelzpunkt | 43-48 °C |
| Siedepunkt | 105-107°C 1mm |
| Dichte | 1.5617 (rough estimate) |
| Brechungsindex | 1.6641 (estimate) |
| Flammpunkt | 105-107°C/1mm |
| Lagerbedingungen | Keep in dark place,Inert atmosphere,Room temperature |
| Aggregatzustand | powder to crystal |
| pKa (Säurekonstante) | 3.88±0.12(Predicted) |
| Farbe | White to Light yellow to Green |
| BRN | 115148 |
| InChI | InChI=1S/C9H6BrN/c10-8-4-1-5-9-7(8)3-2-6-11-9/h1-6H |
| InChIKey | CHODTZCXWXCALP-UHFFFAOYSA-N |
| SMILES | N1C2C(=C(Br)C=CC=2)C=CC=1 |
| CAS Datenbank | 4964-71-0(CAS DataBase Reference) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH302 (87.5%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, 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 48 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Acute Tox. 4 (87.5%) |
| Wassergefährdungsklasse (WGK) | 3 |
| Zollcode | 29334900 |
| R-Sätze (R) | 36/37/38-20/21/22-22 |
| Gefahrensymbole | Xi,Xn |
| hazard_note | Irritant |
| Sicherheitshinweise (S) | 26-36 |
| Lagerklasse | 11 - Combustible Solids |
| Gefahrenklasse | Acute Tox. 4 OralEye Dam. 1Skin Irrit. 2STOT SE 3 |
Anwendungen & Verwendung
Verwenden
5-Bromoquinoline is a biochemical reagent that can be used as a biological material or organic compound for life science related research.