CAS
916791-38-3 Purity
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916791-38-3 Purity
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The molecular formula is C4H2BrN3.
The molecular weight is 171.98 g/mol.
Some synonyms include 4-bromo-1H-pyrazole-3-carbonitrile and 4-Bromopyrazole-3-carbonitrile.
The InChIKey is ZXVFKQRZKKGVNJ-UHFFFAOYSA-N.
The Canonical SMILES is C1=NNC(=C1Br)C#N.
The exact mass is 170.94321 g/mol.
It has 1 hydrogen bond donor count.
It has 2 hydrogen bond acceptor counts.
Yes, it is a canonicalized compound.
It has 1 covalently-bonded unit count.