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Specification
The molecular formula of 1-Chloro-5-fluoro-2,4-dinitrobenzene is C6H2ClFN2O4.
The molecular weight of 1-Chloro-5-fluoro-2,4-dinitrobenzene is 220.54 g/mol.
The IUPAC name of 1-Chloro-5-fluoro-2,4-dinitrobenzene is 1-chloro-5-fluoro-2,4-dinitrobenzene.
The InChI of 1-Chloro-5-fluoro-2,4-dinitrobenzene is InChI=1S/C6H2ClFN2O4/c7-3-1-4(8)6(10(13)14)2-5(3)9(11)12/h1-2H.
The InChIKey of 1-Chloro-5-fluoro-2,4-dinitrobenzene is RXVKLMKODREOIW-UHFFFAOYSA-N.
The canonical SMILES of 1-Chloro-5-fluoro-2,4-dinitrobenzene is C1=C(C(=CC(=C1[N+](=O)[O-])Cl)F)[N+](=O)[O-].
The CAS number of 1-Chloro-5-fluoro-2,4-dinitrobenzene is 327-91-3.
The EC number of 1-Chloro-5-fluoro-2,4-dinitrobenzene is 811-658-0.
The DSSTox Substance ID of 1-Chloro-5-fluoro-2,4-dinitrobenzene is DTXSID90278832.
Yes, 1-Chloro-5-fluoro-2,4-dinitrobenzene is a canonicalized compound.