57090-88-7 | 1H-Imidazole-4-carbonitrile

Packsize	Purity	Availability	Price	Discounted Price
100mg	98%	in stock	$6.00	$4.00
250mg	98%	in stock	$8.00	$5.00
1g	98%	in stock	$8.00	$6.00
5g	98%	in stock	$22.00	$16.00
10g	98%	in stock	$40.00	$28.00
25g	98%	in stock	$96.00	$67.00
100g	98%	in stock	$323.00	$226.00

Description

• Catalog Number: AB49611
• Chemical Name: 1H-Imidazole-4-carbonitrile
• CAS Number: 57090-88-7
• Molecular Formula: C4H3N3
• Molecular Weight: 93.0867
• MDL Number: MFCD00233358
• SMILES: c1c(nc[nH]1)C#N

Computed Properties

• Complexity: 101
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 7
• Hydrogen Bond Acceptor Count: 2
• Hydrogen Bond Donor Count: 1
• XLogP3: 0.1

Upstream Synthesis Route

1H-Imidazole-4-carbonitrile is a versatile compound frequently employed in chemical synthesis for the creation of various pharmaceuticals, agrochemicals, and organic compounds. This heterocyclic structure serves as a fundamental building block in the development of biologically active molecules due to its ability to participate in diverse reactions.One notable application of 1H-Imidazole-4-carbonitrile is as a key intermediate in the synthesis of pharmaceutical drugs such as anti-fungal agents and anti-inflammatory medications. Its unique chemical properties enable it to undergo reactions with a range of functional groups, allowing for the incorporation of specific functionalities required for the desired biological activity.Furthermore, 1H-Imidazole-4-carbonitrile can be utilized in the preparation of ligands for metal-catalyzed reactions, serving as a chelating agent to stabilize metal complexes during catalysis. Its ability to coordinate with metal ions enhances the efficiency and selectivity of various chemical transformations, making it a valuable tool in synthetic chemistry.Overall, the strategic incorporation of 1H-Imidazole-4-carbonitrile into chemical synthesis enables the efficient construction of complex molecules with diverse applications in the fields of pharmaceuticals, materials science, and biotechnology. Its role as a versatile building block underscores its significance in advancing the synthesis of novel compounds with tailored properties and functions.

Literature

• trans-Diaqua-bis[5-(1H-imidazol-4-yl-κN)-1H-tetra-zolato-κN]zinc(II).

  Acta crystallographica. Section E, Structure reports online 20090501

• 4-cyanoimidazolate: a new pseudo-cyanide?

  Inorganic chemistry 20040809