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3-Cyanopyridine-[2,4,5,6-d4]

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General Information
Catalog: BLP-012972
CAS: 1020719-32-7
Molecular Formula: C6D4N2
Molecular Weight: 108.13

Chemical Structure

Synonyms	3-Cyanopyridine-2,4,5,6-D4; 3-Pyridine-2,4,5,6-d4-carbonitrile; Nicotinonitrile-d4; 3-Azabenzonitrile-d4; 3-Pyridinenitrile-d4; 3-Pyridyl Cyanide-d4; 3-Pyridylcarbonitrile-d4; NSC 17558-d4; β-Cyanopyridine-d4
IUPAC Name	2,4,5,6-tetradeuteriopyridine-3-carbonitrile
Related CAS	100-54-9 (unlabelled)
Isomeric SMILES	[2H]C1=C(C(=C(N=C1[2H])[2H])C#N)[2H]
Canonical SMILES	C1=CC(=CN=C1)C#N
InChI	InChI=1S/C6H4N2/c7-4-6-2-1-3-8-5-6/h1-3,5H/i1D,2D,3D,5D
InChI Key	GZPHSAQLYPIAIN-RZIJKAHPSA-N
Melting Point	50-52°C
Purity	98%; 98% atom D
Solubility	Soluble in Chloroform, Ethyl Acetate, Methanol
Appearance	Off-white to Pale Yellow Solid
Storage	Store at -20°C