168899-61-4 Purity
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Specification
The molecular formula of 2-Bromo-4-(trifluoromethoxy)aniline is C7H5BrF3NO.
The molecular weight of 2-Bromo-4-(trifluoromethoxy)aniline is 256.02 g/mol.
The IUPAC name of 2-Bromo-4-(trifluoromethoxy)aniline is 2-bromo-4-(trifluoromethoxy)aniline.
The InChI of 2-Bromo-4-(trifluoromethoxy)aniline is InChI=1S/C7H5BrF3NO/c8-5-3-4(1-2-6(5)12)13-7(9,10)11/h1-3H,12H2.
The InChIKey of 2-Bromo-4-(trifluoromethoxy)aniline is ROSTYHNIIDIBEG-UHFFFAOYSA-N.
The canonical SMILES of 2-Bromo-4-(trifluoromethoxy)aniline is C1=CC(=C(C=C1OC(F)(F)F)Br)N.
The CAS number of 2-Bromo-4-(trifluoromethoxy)aniline is 175278-17-8.
The European Community (EC) number of 2-Bromo-4-(trifluoromethoxy)aniline is 629-119-1.
The DSSTox Substance ID of 2-Bromo-4-(trifluoromethoxy)aniline is DTXSID10350866.
Yes, 2-Bromo-4-(trifluoromethoxy)aniline is a canonicalized compound.