549029

3-Bromo-5-fluorobenzotrifluoride

97%

• Linear Formula: BrC₆H₃(F)CF₃
• CAS Number: 130723-13-6
• Molecular Weight: 243.00
• MDL number: MFCD00042498
• UNSPSC Code: 12352100
• PubChem Substance ID: 24878956
• NACRES: NA.22

Properties

• assay: 97%
• refractive index: n20/D 1.456 (lit.)
• bp: 138-139 °C (lit.)
• density: 1.511 g/mL at 25 °C (lit.)
• SMILES string: Fc1cc(Br)cc(c1)C(F)(F)F
• InChI: 1S/C7H3BrF4/c8-5-1-4(7(10,11)12)2-6(9)3-5/h1-3H
• InChI key: LIGBGEJPUQBLTG-UHFFFAOYSA-N

Description

Application

3-Bromo-5-fluorobenzotrifluoride (1-Bromo-3-fluoro-5-(trifluoromethyl)benzene) may be used in the preparation of:[1]

• 6-(3-fluoro-5-trifluoromethylphenyl)-hex-5-ynoic acid methyl ester
• (E)-5-[1-(3-fluoro-5-trifluoromethylphenyl)-5-methoxycarbonyl-pent-1-enyl]-2-methoxy-3-methylbenzoic acid methyl ester
• (E)-3-[4-(3-fluoro-5-trifluoromethylphenyl)-4-(3,4-dimethoxyphenyl)-but-3-enyl]-oxazolidin-2-one
• (E)-5-[1-(3-fluoro-5-trifluoromethylphenyl)-4-(2-oxo-oxazolidin-3-yl)-but-1-enyl]-2-methoxy-3-methylbenzoic acid methyl ester

Safety Information

• Storage Class: 12 - Non Combustible Liquids
• wgk_germany: WGK 3
• flash_point_f: Not applicable
• flash_point_c: Not applicable
• ppe: Eyeshields, Gloves, multi-purpose combination respirator cartridge (US)