369578

4-Methylphenylbenzoat

99%

• Synonym(e): p-Tolyl benzoate
• Lineare Formel: C₆H₅CO₂C₆H₄CH₃
• CAS-Nummer: 614-34-6
• Molekulargewicht: 212.24
• EG-Nummer: 210-380-1
• MDL-Nummer: MFCD00025982
• UNSPSC-Code: 12352100
• PubChem Substanz-ID: 24862992
• NACRES: NA.22

Eigenschaften

• Assay: 99%
• Form: solid
• mp (Schmelzpunkt): 70-72 °C (lit.)
• Funktionelle Gruppe: ester; phenyl
• SMILES String: Cc1ccc(OC(=O)c2ccccc2)cc1
• InChI: 1S/C14H12O2/c1-11-7-9-13(10-8-11)16-14(15)12-5-3-2-4-6-12/h2-10H,1H3
• InChIKey: LLRZUDIHEZXFGV-UHFFFAOYSA-N

Beschreibung

Allgemeine Beschreibung

4-Methylphenyl benzoate is an ester. Structure of 4-methylphenyl benzoate resembles phenyl benzoate and 4-methoxy­phenyl benzoate, in terms of similar geometric parameters. The dihedral angle between the phenyl and benzene rings in 4-methylphenyl benzoate is 60.17 (7)°.[1] Fries rearrangement of 4-methoxy­phenyl benzoate catalyzed by sulfated zirconia is reported.[2]

Sicherheitshinweise

• Lagerklassenschlüssel: 11 - Combustible Solids
• WGK: WGK 2
• Flammpunkt (°F): Not applicable
• Flammpunkt (°C): Not applicable
• Persönliche Schutzausrüstung: Eyeshields, Gloves, type N95 (US)