CAS 101420-63-7

4-Methyl-7-nitro-1H-benzimidazole

Description:

4-Methyl-7-nitro-1H-benzimidazole is a chemical compound characterized by its unique structure, which consists of a benzimidazole core substituted with a methyl group at the 4-position and a nitro group at the 7-position. This compound typically appears as a solid and is known for its potential applications in various fields, including pharmaceuticals and materials science. The presence of the nitro group contributes to its reactivity and may influence its biological activity, making it of interest in medicinal chemistry. The compound's molecular formula reflects its composition, and its properties, such as solubility and melting point, can vary based on environmental conditions and purity. Additionally, 4-Methyl-7-nitro-1H-benzimidazole may exhibit specific spectral characteristics in techniques like NMR and IR spectroscopy, aiding in its identification and analysis. As with many chemical substances, safety data sheets should be consulted for handling and storage guidelines, as well as potential hazards associated with its use.

Formula: C₈H₇N₃O₂

InChI: InChI=1S/C8H7N3O2/c1-5-2-3-6(11(12)13)8-7(5)9-4-10-8/h2-4H,1H3,(H,9,10)

InChI key: InChIKey=VHOZELJWOZJICK-UHFFFAOYSA-N

SMILES: N(=O)(=O)C1=C2C(=C(C)C=C1)N=CN2

Synonyms:

• 1H-Benzimidazole, 4-methyl-7-nitro-
• Benzimidazole, 4-methyl-7-nitro-
• 4-Methyl-7-nitro-1H-benzimidazole