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Specification
The molecular formula of 4-Bromo-1,1,1-trifluorobutane is C4H6BrF3.
The molecular weight of 4-Bromo-1,1,1-trifluorobutane is 190.99 g/mol.
The IUPAC name of 4-Bromo-1,1,1-trifluorobutane is 4-bromo-1,1,1-trifluorobutane.
The InChI of 4-Bromo-1,1,1-trifluorobutane is InChI=1S/C4H6BrF3/c5-3-1-2-4(6,7)8/h1-3H2.
The InChIKey of 4-Bromo-1,1,1-trifluorobutane is DBCAQXHNJOFNGC-UHFFFAOYSA-N.
The canonical SMILES of 4-Bromo-1,1,1-trifluorobutane is C(CC(F)(F)F)CBr.
The CAS number of 4-Bromo-1,1,1-trifluorobutane is 406-81-5.
The European Community (EC) number of 4-Bromo-1,1,1-trifluorobutane is 670-279-7.
The DSSTox Substance ID of 4-Bromo-1,1,1-trifluorobutane is DTXSID50334529.
Yes, 4-Bromo-1,1,1-trifluorobutane is a canonicalized compound.