4-Bromobenzotrifluoride

CAS: 402-43-7

Ref. TR-B680525

Product Information

• Name: 4-Bromobenzotrifluoride
• Synonyms: 1-Bromo-4-(trifluoromethyl)benzene, p-Bromo-alpha,alpha,alpha-trifluorotoluene, 1-Bromo-4-(trifluoromethyl)benzene, 4-(Trifluoromethyl)bromobenzene, 4-(Trifluoromethyl)phenyl bromide, 4-Bromo(trifluoromethyl)benzene, 4-Bromo-1-(trifluoromethyl)benzene, 4-Bromo-alpha,alpha,alpha-trifluorotoluene, 4-Trifluoromethyl-1-bromobenzene, p-(Trifluoromethyl)bromobenzene, p-(Trifluoromethyl)phenyl Bromide, p-Bromo(trifluoromethyl)benzene, p-Bromobenzotrifluoride
• Brand: TRC
• Description: Applications 4-Bromobenzotrifluoride is an aromatic compound that is used as a reagent to synthesize Bergenin (B318650), a compound that originates in Mallotus japonicus that exhibits hepatoprotective and antioxidant effects. 4-Bromobenzotrifluoride is also used as a reagent to prepare (±)-Preclamol, a partial dopamine D2 agonist that is used to treat Parkinson’s disease. Not a dangerous good if item is equal to or less than 1g/ml and there is less than 100g/ml in the packageReferences Lim, H., et al.: Pharmacology, 63, 71 (2001); Parkan, K., et al.: Chem. Eur. J., 20, 4414 (2014); Pirtosek, Z., et al.: Clin. Neuro., 16, 550 (1993); Takahashi, H., et al.: Bioorg. Med. Chem., 11, 1781 (2003); Vasdev, N., et al.: Synapse, 60, 314 (2006)

Chemical properties

• Molecular weight: 251.321
• Formula: C₁₄H₂₁NO₃
• Color/Form: Neat
• InChI: InChI=1S/C14H21NO3/c1-17-12-5-3-4-11(14(12)18-2)13(16)10-6-8-15-9-7-10/h3-5,10,13,15-16H,6-9H2,1-2H3/t13-/m1/s1
• InChI key: InChIKey=LZRHDSQWBVFQMC-CYBMUJFWSA-N
• SMILES: COc1cccc([C@H](O)C2CCNCC2)c1OC