9004-57-3 Purity
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Specification
The molecular formula is C12H4F8N2.
The molecular weight is 328.16 g/mol.
The IUPAC name is 4-(4-amino-2,3,5,6-tetrafluorophenyl)-2,3,5,6-tetrafluoroaniline.
The InChI is InChI=1S/C12H4F8N2/c13-3-1(4(14)8(18)11(21)7(3)17)2-5(15)9(19)12(22)10(20)6(2)16/h21-22H2.
The InChIKey is FWOLORXQTIGHFX-UHFFFAOYSA-N.
The canonical SMILES is C1(=C(C(=C(C(=C1F)F)N)F)F)C2=C(C(=C(C(=C2F)F)N)F)F.
The CAS number is 1038-66-0.
The EC number is 213-861-4.
The DSSTox Substance ID is DTXSID8061424.
Yes, 4,4-Diaminooctafluorobiphenyl is a canonicalized compound.