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The molecular formula of 3-Cyanopyridine-2-boronicacid is C6H5BN2O2.
The molecular weight of 3-Cyanopyridine-2-boronicacid is 147.93 g/mol.
The IUPAC name of 3-Cyanopyridine-2-boronicacid is (3-cyanopyridin-2-yl)boronic acid.
The InChI key of 3-Cyanopyridine-2-boronicacid is ZXAQFSKZTTWNOG-UHFFFAOYSA-N.
The canonical SMILES representation of 3-Cyanopyridine-2-boronicacid is B(C1=C(C=CC=N1)C#N)(O)O.
The CAS number of 3-Cyanopyridine-2-boronicacid is 851199-86-5.
The hydrogen bond donor count of 3-Cyanopyridine-2-boronicacid is 2.
The hydrogen bond acceptor count of 3-Cyanopyridine-2-boronicacid is 4.
The rotatable bond count of 3-Cyanopyridine-2-boronicacid is 1.
Yes, 3-Cyanopyridine-2-boronicacid is considered a canonicalized compound.
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