HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
3-Butenylbenzene
But-3-en-1-ylbenzene · 4-Phenylbut-1-ene · Phenylbutene · 4-Phenylbutene · 3-butenyl-benzene · 1-Butene, 4-phenyl- · 4PB-1 · 4-Phenylbutene-1
Identifikatoren & physikalische Daten
| CAS No. | 768-56-9 |
|---|---|
| Summenformel | C10H12 |
| Durchschnittliche Molmasse | 132,2 g/mol |
| Monoisotopische Masse | 132,09390038 g/mol |
| SMILES | C=CCCc1ccccc1 |
| InChIKey | PBGVMIDTGGTBFS-UHFFFAOYSA-N |
| PubChem CID | 13033 |
| EC No. | 405-980-7 |
| DTXSID | DTXSID80227612 |
Chemische & physikalische Eigenschaften
| XLogP | 3,3 |
|---|---|
| Polarare Oberfläche (TPSA) | 0 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 0 |
| Frei drehbare Bindungen | 3 |
| Schwere Atome | 10 |
| Formalladung | 0 |
| Komplexität | 88 |
| Kovats Retention Index | 10321038.51022 |
| Schmelzpunkt | -70°C |
| Siedepunkt | 175-177 °C (lit.) |
| Dichte | 0.88 g/mL at 25 °C (lit.) |
| Brechungsindex | n20/D 1.507(lit.) |
| Flammpunkt | 140 °F |
| Aggregatzustand | clear liquid |
| Farbe | Colorless to Almost colorless |
| Wichte | 0.880 |
| InChI | 1S/C10H12/c1-2-3-7-10-8-5-4-6-9-10/h2,4-6,8-9H,1,3,7H2 |
| InChIKey | PBGVMIDTGGTBFS-UHFFFAOYSA-N |
| SMILES | C=CCCc1ccccc1 |
| CAS Datenbank | 768-56-9(CAS DataBase Reference) |
| NIST chemische Informationen | Benzene, 3-butenyl-(768-56-9) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315: Causes skin irritation [Warning Skin corrosion/irritation]H411: Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]P264, P273, P280, P302+P352, P321, P332+P317, P362+P364, P391, and P501 (click each P-code to see the statement) |
|---|---|
| Regulatorische Informationen | Status: Active Update: 15-12-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/14058 |
| Hazard Classes and Categories | Flam. Liq. 3 (60%)Skin Irrit. 2 (100%)Aquatic Chronic 2 (100%)Flam. Liq. 3 (100%)Skin irritation - category 2Hazardous to the aquatic environment (chronic) - category 2Aquatic Chronic 2 |
| Wassergefährdungsklasse (WGK) | 2 |
| UN-Transportnummer | UN 3295 3/PG 3 |
| Zollcode | 2902.90.9000 |
| RTECS-Nr. | EM9000000 |
| R-Sätze (R) | 38-51/53 |
| Gefahrensymbole | Xi,N |
| Sicherheitshinweise (S) | 37-61 |
| Gefahrenklasse | 3.2Aquatic Chronic 2Flam. Liq. 3Skin Irrit. 2 |
| Verpackungsgruppe | III |
| Lagerklasse | 3 - Flammable liquids |
Anwendungen & Verwendung
Verwenden
4-Phenyl-1-butene can be used as a monomer precursor to synthesize poly(4-phenyl-1-butene) via heterogeneous catalytic-polymerization reaction. It is also utilized to make olefinic copolymers with different substrates, such as 11-bromo-1-undecene, ethylene, and vinylpyrrolidone, etc., for a variety of polymer applications. It can also be used as a reactant to synthesize: (3-Chlorobutyl)benzene via cobalt catalyzed hydrochlorination reaction. Naphthalene by Cu-Pt alloy catalyzed dehydrocyclization reaction.