216089

Methyl-4-chlorbenzoat

99%

• Lineare Formel: ClC₆H₄CO₂CH₃
• CAS-Nummer: 1126-46-1
• Molekulargewicht: 170.59
• EG-Nummer: 214-420-9
• MDL-Nummer: MFCD00000621
• UNSPSC-Code: 12352100
• PubChem Substanz-ID: 24852938

Eigenschaften

• Assay: 99%
• Form: solid
• mp (Schmelzpunkt): 42-44 °C (lit.)
• SMILES String: COC(=O)c1ccc(Cl)cc1
• InChI: 1S/C8H7ClO2/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5H,1H3
• InChIKey: LXNFVVDCCWUUKC-UHFFFAOYSA-N

Beschreibung

Allgemeine Beschreibung

Methyl 4-chlorobenzoate undergoes room temperature Pd-mediated hydrodehalogenation with KF and polymethylhydrosiloxane (PMHS) to yield methyl benzoate. It undergoes Suzuki-Miyaura coupling reaction with phenylboronic acid in the presence of bis-carbene palladium complex catalyst to yield methyl-(4-phenyl)-benzoate.

Anwendung

Methyl 4-chlorobenzoate was used in quantitative determination of chlorophenoxyisobutyrate (CPIB) and salicylic acid, the metabolites of clofibrate and aspirin, by GC-MS method.

Sicherheitshinweise

• Lagerklassenschlüssel: 11 - Combustible Solids
• WGK: WGK 3
• Flammpunkt (°F): 224.6 °F - closed cup
• Flammpunkt (°C): 107.00 °C - closed cup
• Persönliche Schutzausrüstung: Eyeshields, Gloves, type N95 (US)