HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
Methyl 4-ethenylbenzoate
Methyl 4-vinylbenzoate 97% · Benzoic acid, 4-ethenyl-, methyl ester · Methyl 4-vinylbenzoate · Methyl p-vinylbenzoate · p-Vinylbenzoic acid methyl ester · 4-VINYL-BENZOIC ACID METHYL ESTER · 4-ethenyl-Benzoic acid Methyl ester · 4-Styrenecarboxylic acid methyl ester
Identifikatoren & physikalische Daten
| CAS No. | 1076-96-6 |
|---|---|
| Summenformel | C10H10O2 |
| Durchschnittliche Molmasse | 162,18 g/mol |
| Monoisotopische Masse | 162,06807956 g/mol |
| SMILES | C=Cc1ccc(C(=O)OC)cc1 |
| InChIKey | NUMHUJZXKZKUBN-UHFFFAOYSA-N |
| PubChem CID | 583124 |
| EC No. | 627-153-1 |
| DTXSID | DTXSID30342586 |
Chemische & physikalische Eigenschaften
| XLogP | 3,1 |
|---|---|
| Polarare Oberfläche (TPSA) | 26,3 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 3 |
| Schwere Atome | 12 |
| Formalladung | 0 |
| Komplexität | 167 |
| SpringerMaterials Properties | 13C nuclear magnetic resonance spectrum |
| Schmelzpunkt | 32-36 °C(lit.) |
| Siedepunkt | 89-90℃ (2 Torr) |
| Dichte | 1.058±0.06 g/cm3(Predicted) |
| Brechungsindex | 1.5568 (589.3 nm 25℃) |
| Flammpunkt | >230 °F |
| Lagerbedingungen | 2-8°C |
| Aggregatzustand | crystals |
| Farbe | White |
| InChI | InChI=1S/C10H10O2/c1-3-8-4-6-9(7-5-8)10(11)12-2/h3-7H,1H2,2H3 |
| InChIKey | NUMHUJZXKZKUBN-UHFFFAOYSA-N |
| SMILES | C(OC)(=O)C1=CC=C(C=C)C=C1 |
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 41 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
| Wassergefährdungsklasse (WGK) | 3 |
| Zollcode | 2916399090 |
| R-Sätze (R) | 36/37/38 |
| Gefahrensymbole | Xi |
| Sicherheitshinweise (S) | 26-36/37 |
Anwendungen & Verwendung
Verwenden
Methyl 4-vinylbenzoate is used as a fluid component for enhancing ink stability in printing and also in preparing vinyl substituted beta-diketones. Further, it is used as an organic intermediate for pharmaceuticals.