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The molecular formula is C8H6BrF3O.
The IUPAC name is 1-bromo-3-methoxy-5-(trifluoromethyl)benzene.
The molecular weight is 255.03 g/mol.
The CAS number is 627527-23-5.
The InChI is InChI=1S/C8H6BrF3O/c1-13-7-3-5(8(10,11)12)2-6(9)4-7/h2-4H,1H3.
The InChIKey is IBEKZIYJONXDRY-UHFFFAOYSA-N.
The canonical SMILES is COC1=CC(=CC(=C1)C(F)(F)F)Br.
The XLogP3-AA value is 3.5.
It has 0 hydrogen bond donor count.
It has 4 hydrogen bond acceptor count.
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