71701-99-0 Purity
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Specification
The molecular formula of allylpentafluorobenzene is C9H5F5.
The molecular weight of allylpentafluorobenzene is 208.13 g/mol.
The IUPAC name of allylpentafluorobenzene is 1,2,3,4,5-pentafluoro-6-prop-2-enylbenzene.
The InChI of allylpentafluorobenzene is InChI=1S/C9H5F5/c1-2-3-4-5(10)7(12)9(14)8(13)6(4)11/h2H,1,3H2.
The InChIKey of allylpentafluorobenzene is YBDBTBVNQQBHGJ-UHFFFAOYSA-N.
The canonical SMILES of allylpentafluorobenzene is C=CCC1=C(C(=C(C(=C1F)F)F)F)F.
The CAS number of allylpentafluorobenzene is 1736-60-3.
The European Community (EC) number of allylpentafluorobenzene is 217-083-6.
The Nikkaji Number of allylpentafluorobenzene is J101.782I.
Yes, allylpentafluorobenzene is a canonicalized compound.