HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
1-Azido-4-bromobenzene
p-Bromophenyl azide · 1-Azido-4-bromobenzene · 1-Bromo-4-azidobenzene · 4-Bromophenyl azide solution · 1-Azido-4-broMobenzene solution · 1-Azido-4-bromobenzene ~0.5M solution in t-butyl methyl ether
Identifikatoren & physikalische Daten
| CAS No. | 2101-88-4 |
|---|---|
| Summenformel | C6H4BrN3 |
| Durchschnittliche Molmasse | 198,02 g/mol |
| Monoisotopische Masse | 196,95886 g/mol |
| SMILES | [N-]=[N+]=Nc1ccc(Br)cc1 |
| InChIKey | WHSJSMSBFMDFHK-UHFFFAOYSA-N |
| PubChem CID | 75005 |
| ChEMBL | CHEMBL3236178 |
| EC No. | 663-402-0 |
| DTXSID | DTXSID10175218 |
Chemische & physikalische Eigenschaften
| XLogP | 3,7 |
|---|---|
| Polarare Oberfläche (TPSA) | 14,4 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 1 |
| Schwere Atome | 10 |
| Formalladung | 0 |
| Komplexität | 145 |
| Schmelzpunkt | 20°C |
| Siedepunkt | 105 °C(Press: 10 Torr) |
| Dichte | 1.5827 |
| Brechungsindex | 1.6400 (estimate) |
| Flammpunkt | -33℃ |
| Lagerbedingungen | -20°C |
| Aggregatzustand | liquid |
| BRN | 1939308 |
| InChI | InChI=1S/C6H4BrN3/c7-5-1-3-6(4-2-5)9-10-8/h1-4H |
| InChIKey | WHSJSMSBFMDFHK-UHFFFAOYSA-N |
| SMILES | C1(N=[N+]=[N-])=CC=C(Br)C=C1 |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH241 (92.9%): Heating may cause a fire or explosion [Danger Self-reactive substances and mixturesOrganic peroxides]H315 (92.9%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (92.9%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (92.9%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]H372 (97.6%): Causes damage to organs through prolonged or repeated exposure [Danger Specific target organ toxicity, repeated exposure]P210, P234, P235, P240, P260, P261, P264, P264+P265, P270, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P380+P375[+P378], P403, P403+P233, P405, P410, P411, P420, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 42 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website. |
|---|---|
| Hazard Classes and Categories | Self-react. B (92.9%)Skin Irrit. 2 (92.9%)Eye Irrit. 2 (92.9%)STOT SE 3 (92.9%)STOT RE 1 (97.6%) |
| Wassergefährdungsklasse (WGK) | 3 |
| UN-Transportnummer | UN 2398 3 / PGII |
| R-Sätze (R) | 11-38-48/23/24/25 |
| Gefahrensymbole | F,T |
| Sicherheitshinweise (S) | 16 |
| Lagerklasse | 3 - Flammable liquids |
| Gefahrenklasse | Eye Irrit. 2Flam. Liq. 2Skin Irrit. 2STOT RE 1 |