288246-16-2 Purity
96%
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Specification
The molecular formula of 3-Bromo-5-iodobenzonitrile is C7H3BrIN.
The molecular weight of 3-Bromo-5-iodobenzonitrile is 307.91 g/mol.
The IUPAC name of 3-Bromo-5-iodobenzonitrile is 3-bromo-5-iodobenzonitrile.
The InChI of 3-Bromo-5-iodobenzonitrile is InChI=1S/C7H3BrIN/c8-6-1-5(4-10)2-7(9)3-6/h1-3H.
The InChIKey of 3-Bromo-5-iodobenzonitrile is LHQMIDOWAGGZMD-UHFFFAOYSA-N.
The canonical SMILES of 3-Bromo-5-iodobenzonitrile is C1=C(C=C(C=C1Br)I)C#N.
The CAS number of 3-Bromo-5-iodobenzonitrile is 289039-21-0.
The XLogP3-AA value of 3-Bromo-5-iodobenzonitrile is 3.
3-Bromo-5-iodobenzonitrile has 0 hydrogen bond donor counts.
3-Bromo-5-iodobenzonitrile has 1 hydrogen bond acceptor count.