1201-31-6 Purity
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Specification
The PubChem CID for 3,5-Difluorophenylacetonitrile is 518565.
The molecular formula of 3,5-Difluorophenylacetonitrile is C8H5F2N.
The molecular weight of 3,5-Difluorophenylacetonitrile is 153.13 g/mol.
The IUPAC name of 3,5-Difluorophenylacetonitrile is 2-(3,5-difluorophenyl)acetonitrile.
The InChI of 3,5-Difluorophenylacetonitrile is InChI=1S/C8H5F2N/c9-7-3-6(1-2-11)4-8(10)5-7/h3-5H,1H2.
The InChIKey of 3,5-Difluorophenylacetonitrile is OBMYMTSBABEPIB-UHFFFAOYSA-N.
The canonical SMILES of 3,5-Difluorophenylacetonitrile is C1=C(C=C(C=C1F)F)CC#N.
The CAS number of 3,5-Difluorophenylacetonitrile is 122376-76-5.
The European Community (EC) Number of 3,5-Difluorophenylacetonitrile is 625-700-9.
Yes, 3,5-Difluorophenylacetonitrile is a canonicalized compound.