99-90-1 Purity
95%+
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The molecular formula of 4-Bromo-3-nitrobenzotrifluoride is C7H3BrF3NO2.
The molecular weight of 4-Bromo-3-nitrobenzotrifluoride is 270.00 g/mol.
The IUPAC name of 4-Bromo-3-nitrobenzotrifluoride is 1-bromo-2-nitro-4-(trifluoromethyl)benzene.
The InChI of 4-Bromo-3-nitrobenzotrifluoride is InChI=1S/C7H3BrF3NO2/c8-5-2-1-4(7(9,10)11)3-6(5)12(13)14/h1-3H.
The InChIKey of 4-Bromo-3-nitrobenzotrifluoride is PESPBNYBZVIGRO-UHFFFAOYSA-N.
The Canonical SMILES of 4-Bromo-3-nitrobenzotrifluoride is C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])Br.
The CAS number of 4-Bromo-3-nitrobenzotrifluoride is 349-03-1.
The European Community (EC) Number of 4-Bromo-3-nitrobenzotrifluoride is 670-406-6.
The DSSTox Substance ID of 4-Bromo-3-nitrobenzotrifluoride is DTXSID60334434.
Yes, 4-Bromo-3-nitrobenzotrifluoride is a canonicalized compound.