105174-97-8 Purity
96%
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The molecular formula of 1-Bromo-3-fluoro-4-(trifluoromethoxy)benzene is C7H3BrF4O.
The synonyms of 1-Bromo-3-fluoro-4-(trifluoromethoxy)benzene include 4-bromo-2-fluoro-1-(trifluoromethoxy)benzene and Benzene, 4-bromo-2-fluoro-1-(trifluoromethoxy)-.
The molecular weight of 1-Bromo-3-fluoro-4-(trifluoromethoxy)benzene is 259.00 g/mol.
The IUPAC name of 1-Bromo-3-fluoro-4-(trifluoromethoxy)benzene is 4-bromo-2-fluoro-1-(trifluoromethoxy)benzene.
The InChI of 1-Bromo-3-fluoro-4-(trifluoromethoxy)benzene is InChI=1S/C7H3BrF4O/c8-4-1-2-6(5(9)3-4)13-7(10,11)12/h1-3H.
The InChIKey of 1-Bromo-3-fluoro-4-(trifluoromethoxy)benzene is SBSFDYRKNUCGBZ-UHFFFAOYSA-N.
The canonical SMILES of 1-Bromo-3-fluoro-4-(trifluoromethoxy)benzene is C1=CC(=C(C=C1Br)F)OC(F)(F)F.
The CAS number of 1-Bromo-3-fluoro-4-(trifluoromethoxy)benzene is 105529-58-6.
The European Community (EC) number of 1-Bromo-3-fluoro-4-(trifluoromethoxy)benzene is 430-850-1.
The molecular weight of 1-Bromo-3-fluoro-4-(trifluoromethoxy)benzene is 259.00 g/mol.
The XLogP3-AA of 1-Bromo-3-fluoro-4-(trifluoromethoxy)benzene is 3.9.
The hydrogen bond donor count of 1-Bromo-3-fluoro-4-(trifluoromethoxy)benzene is 0, and the hydrogen bond acceptor count is 5.