HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
Azidobenzol
Azidobenzene · Phenyl azide · Azido-benzene · triazobenzene · phenylazoimide · Benzene, triazo- · diazobenzeneimide · Phenyl azide solution
Identifikatoren & physikalische Daten
| CAS No. | 622-37-7 |
|---|---|
| Summenformel | C6H5N3 |
| Durchschnittliche Molmasse | 119,12 g/mol |
| Monoisotopische Masse | 119,04834716 g/mol |
| SMILES | [N-]=[N+]=Nc1ccccc1 |
| InChIKey | CTRLRINCMYICJO-UHFFFAOYSA-N |
| PubChem CID | 69319 |
| ChEMBL | CHEMBL3236174 |
| EC No. | 210-730-3 |
| DTXSID | DTXSID30878870 |
| Lokaler Name | Azidobenzol |
Chemische & physikalische Eigenschaften
| XLogP | 2,6 |
|---|---|
| Polarare Oberfläche (TPSA) | 14,4 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 1 |
| Schwere Atome | 9 |
| Formalladung | 0 |
| Komplexität | 120 |
| SpringerMaterials Properties | 15N nuclear magnetic resonance spectrum |
| LogP (Verteilungskoeffizient) | 2.59 |
| Schmelzpunkt | -27.5°C |
| Siedepunkt | 212.39°C (rough estimate) |
| Dichte | 1.0860 |
| Dampfdichte | 73.5 at 22-24 mm |
| Brechungsindex | 1.5589 |
| Flammpunkt | -12°C |
| Lagerbedingungen | -20°C |
| Aggregatzustand | liquid |
| Farbe | Pale-yellow oil |
| BRN | 742248 |
| InChI | InChI=1S/C6H5N3/c7-9-8-6-4-2-1-3-5-6/h1-5H |
| InChIKey | CTRLRINCMYICJO-UHFFFAOYSA-N |
| SMILES | C1(N=[N+]=[N-])=CC=CC=C1 |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH241 (97.5%): Heating may cause a fire or explosion [Danger Self-reactive substances and mixturesOrganic peroxides]P210, P234, P235, P240, P260, P264, P264+P265, P270, P280, P302+P352, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P380+P375[+P378], P403, P410, P411, P420, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Self-react. B (97.5%) |
| Wassergefährdungsklasse (WGK) | 3 |
| UN-Transportnummer | UN 2398 3 / PGII |
| R-Sätze (R) | 11-19-48/20/21/22-38 |
| Gefahrensymbole | F,Xn |
| Sicherheitshinweise (S) | 16 |
| Lagerklasse | 3 - Flammable liquids |
| Gefahrenklasse | Acute Tox. 4 OralEye Dam. 1Flam. Liq. 2Skin Irrit. 2STOT RE 2 |
Anwendungen & Verwendung
Verwenden
Phenylazide in greener solvent, 2-methyltetrahydrofuran (2-MeTHF).2-Methyltetrahydrofuran (2-MeTHF): A Biomass-Derived Solvent with Broad Application in Organic Chemistry