HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 16966Erstellt: 27. Oktober 2026
4-Methoxyazobenzene
4-PHENYLAZOANISOLE · NSC 16044 · METHOXYAZOBENZENE · P-PHENYLAZOANISOLE · p-(Phenylazo)anisol · 4-METHOXYAZOBENZENE · P-METHOXYAZOBENZENE · 4-(Benzeneazo)anisole
https://huagongshe.com/de/chemical/16966
Identifikatoren & physikalische Daten
| CAS No. | 21650-49-7 |
|---|
| Summenformel | C13H12N2O |
|---|
| Durchschnittliche Molmasse | 212,25 g/mol |
|---|
| Monoisotopische Masse | 212,094963 g/mol |
|---|
| SMILES | COc1ccc(N=Nc2ccccc2)cc1 |
|---|
| InChIKey | LGCRPKOHRIXSEG-UHFFFAOYSA-N |
|---|
| PubChem CID | 16966 |
|---|
| ChEMBL | CHEMBL4162540 |
|---|
| EC No. | 219-250-9 |
|---|
| DTXSID | DTXSID00870967 |
|---|
Chemische & physikalische Eigenschaften
| XLogP | 4,1 |
|---|
| Polarare Oberfläche (TPSA) | 34 |
|---|
| H-Brücken-Donoren | 0 |
|---|
| H-Brücken-Akzeptoren | 3 |
|---|
| Frei drehbare Bindungen | 3 |
|---|
| Schwere Atome | 16 |
|---|
| Formalladung | 0 |
|---|
| Komplexität | 216 |
|---|
| SpringerMaterials Properties | 15N nuclear magnetic resonance spectrum |
|---|
| Schmelzpunkt | 54-56 °C |
|---|
| Siedepunkt | 340 °C |
|---|
| Dichte | 1.1200 |
|---|
| Brechungsindex | 1.6920 (estimate) |
|---|
| Aggregatzustand | powder to crystal |
|---|
| Farbe | Light yellow to Brown |
|---|
| BRN | 958054 |
|---|
| InChI | 1S/C13H12N2O/c1-16-13-9-7-12(8-10-13)15-14-11-5-3-2-4-6-11/h2-10H,1H3/b15-14+ |
|---|
| InChIKey | LGCRPKOHRIXSEG-CCEZHUSRSA-N |
|---|
| SMILES | COc1ccc(cc1)\N=N\c2ccccc2 |
|---|
| CAS Datenbank | 2396-60-3(CAS DataBase Reference) |
|---|
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315 (100%): 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 4 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|
| Wassergefährdungsklasse (WGK) | 3 |
|---|
| Zollcode | 2927.00.5000 |
|---|
| R-Sätze (R) | 36/37/38 |
|---|
| Sicherheitshinweise (S) | 22-24/25 |
|---|
| Lagerklasse | 11 - Combustible Solids |
|---|
