249475

4-(Trifluoromethyl)benzoyl chloride

97%

• Synonym(s): α,α,α-Trifluoro-p-toluoyl chloride
• Linear Formula: CF₃C₆H₄COCl
• CAS Number: 329-15-7
• Molecular Weight: 208.56
• Beilstein/REAXYS Number: 391282
• EC Number: 206-342-9
• MDL number: MFCD00000694
• UNSPSC Code: 12352100
• PubChem Substance ID: 24854997
• NACRES: NA.22

Properties

• Quality Level: 100
• assay: 97%
• form: liquid
• refractive index: n20/D 1.476 (lit.)
• bp: 188-190 °C (lit.); 78-79 °C/16 mmHg (lit.)
• density: 1.404 g/mL at 25 °C (lit.)
• functional group: acyl chloride; fluoro
• SMILES string: FC(F)(F)c1ccc(cc1)C(Cl)=O
• InChI: 1S/C8H4ClF3O/c9-7(13)5-1-3-6(4-2-5)8(10,11)12/h1-4H
• InChI key: OXZYBOLWRXENKT-UHFFFAOYSA-N

Description

General description

4-(Trifluoromethyl)benzoyl chloride undergoes microwave-promoted Suzuki-type coupling reaction with phenylboronic acid to yield 4-(trifluoromethyl)benzophenone.

Safety Information

• pictograms: GHS05
• signalword: Danger
• hcodes: H314
• pcodes: P280 - P303 + P361 + P353 - P304 + P340 + P310 - P305 + P351 + P338 - P363 - P405
• Hazard Classifications: Eye Dam. 1 - Skin Corr. 1B
• Storage Class: 8A - Combustible corrosive hazardous materials
• wgk_germany: WGK 3
• flash_point_f: 172.4 °F - closed cup
• flash_point_c: 78 °C - closed cup
• ppe: Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter