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The molecular formula of 2-Chloro-2-fluoro-2-phenylacetonitrile is C8H5ClFN.
The molecular weight of 2-Chloro-2-fluoro-2-phenylacetonitrile is 169.58 g/mol.
The IUPAC Name of 2-Chloro-2-fluoro-2-phenylacetonitrile is 2-chloro-2-fluoro-2-phenylacetonitrile.
The InChIKey of 2-Chloro-2-fluoro-2-phenylacetonitrile is AJTCKIAIYHDWLF-UHFFFAOYSA-N.
The Canonical SMILES of 2-Chloro-2-fluoro-2-phenylacetonitrile is C1=CC=C(C=C1)C(C#N)(F)Cl.
The XLogP3-AA value of 2-Chloro-2-fluoro-2-phenylacetonitrile is 2.6.
There are 2 hydrogen bond acceptors in 2-Chloro-2-fluoro-2-phenylacetonitrile.
The exact mass of 2-Chloro-2-fluoro-2-phenylacetonitrile is 169.0094550 g/mol.
There are 11 heavy atoms in the structure of 2-Chloro-2-fluoro-2-phenylacetonitrile.
Yes, 2-Chloro-2-fluoro-2-phenylacetonitrile is a canonicalized compound according to PubChem.
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