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The molecular formula is C8H5N5.
The molecular weight is 171.16 g/mol.
It was created on 2008-02-29 and last modified on 2023-12-30.
The IUPAC name is 2-(1,2,4-triazol-1-yl)pyridine-3-carbonitrile.
The InChI is InChI=1S/C8H5N5/c9-4-7-2-1-3-11-8(7)13-6-10-5-12-13/h1-3,5-6H.
The InChIKey is DXMJLLQDQULJIK-UHFFFAOYSA-N.
The canonical SMILES is C1=CC(=C(N=C1)N2C=NC=N2)C#N.
The XLogP3-AA value is 0.6.
It has 4 hydrogen bond acceptor counts.
Yes, it is a canonicalized compound.
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