114772-38-2 Purity
97.0%(GC)
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The PubChem CID of 2-Fluoro-4-bromophenylacetonitrile is 7172308.
The molecular formula of 2-Fluoro-4-bromophenylacetonitrile is C8H5BrFN.
The molecular weight of 2-Fluoro-4-bromophenylacetonitrile is 214.03 g/mol.
The IUPAC name of 2-Fluoro-4-bromophenylacetonitrile is 2-(4-bromo-2-fluorophenyl)acetonitrile.
The InChI of 2-Fluoro-4-bromophenylacetonitrile is InChI=1S/C8H5BrFN/c9-7-2-1-6(3-4-11)8(10)5-7/h1-2,5H,3H2.
The InChIKey of 2-Fluoro-4-bromophenylacetonitrile is QLASQEZPJFNZQC-UHFFFAOYSA-N.
The canonical SMILES of 2-Fluoro-4-bromophenylacetonitrile is C1=CC(=C(C=C1Br)F)CC#N.
The CAS number of 2-Fluoro-4-bromophenylacetonitrile is 114897-91-5.
The European Community (EC) number of 2-Fluoro-4-bromophenylacetonitrile is 640-324-5.
The topological polar surface area of 2-Fluoro-4-bromophenylacetonitrile is 23.8 Ų.