99459-09-3 Purity
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Specification
The molecular formula is C9H8N2O3.
It was created on 2007-02-08.
The molecular weight is 192.17 g/mol.
The IUPAC Name is 2-(2-methoxy-5-nitrophenyl)acetonitrile.
There are 0 hydrogen bond donor counts.
The Canonical SMILES is COC1=C(C=C(C=C1)[N+](=O)[O-])CC#N.
There are 2 rotatable bond counts.
The Exact Mass is 192.05349212 g/mol.
Yes, the compound is canonicalized.
The InChIKey is ICFOJUUJPXGJNE-UHFFFAOYSA-N.
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