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| IUPAC Name: | 1-bromo-4-(trifluoromethyl)benzene |
| Description: | 4-Bromobenzotrifluoride (CAS# 402-43-7) 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. |
| Molecular Weight: | 225.01 |
| Molecular Formula: | C7H4BrF3 |
| Canonical SMILES: | C1=CC(=CC=C1C(F)(F)F)Br |
| InChI: | InChI=1S/C7H4BrF3/c8-6-3-1-5(2-4-6)7(9,10)11/h1-4H |
| InChI Key: | XLQSXGGDTHANLN-UHFFFAOYSA-N |
| Boiling Point: | 154-155 ℃ |
| Purity: | 98 % |
| Density: | 1.6 g/cm3 |
| Appearance: | Clear colourless to light yellow liquid |
| MDL: | MFCD00000398 |
| LogP: | 3.46790 |
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Halides
1-(4-Bromo-2-ethylpyrazol-3-yl)-N-methylmethanamine hydrochloride
1-{4-[3-(Trifluoromethyl)-1H-pyrazol-1-yl]phenyl}methanamine hydrochloride
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