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The molecular formula of 2-methyl-6-nitrobenzonitrile is C8H6N2O2.
The molecular weight of 2-methyl-6-nitrobenzonitrile is 162.15 g/mol.
The IUPAC name of 2-methyl-6-nitrobenzonitrile is 2-methyl-6-nitrobenzonitrile.
The InChI of 2-methyl-6-nitrobenzonitrile is InChI=1S/C8H6N2O2/c1-6-3-2-4-8(10(11)12)7(6)5-9/h2-4H,1H3.
The InChIKey of 2-methyl-6-nitrobenzonitrile is BOTPDHNZLRJZOO-UHFFFAOYSA-N.
The canonical SMILES of 2-methyl-6-nitrobenzonitrile is CC1=C(C(=CC=C1)[N+](=O)[O-])C#N.
The CAS number of 2-methyl-6-nitrobenzonitrile is 1885-76-3.
The European Community (EC) Number of 2-methyl-6-nitrobenzonitrile is 217-553-0.
Yes, 2-methyl-6-nitrobenzonitrile is canonicalized.
2-methyl-6-nitrobenzonitrile has 3 hydrogen bond acceptor counts.
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