CAS 5805-42-5

2-Ethyl-6-nitro-1H-benzimidazole

Description:

2-Ethyl-6-nitro-1H-benzimidazole is an organic compound characterized by its benzimidazole core, which consists of a fused benzene and imidazole ring. This compound features an ethyl group at the 2-position and a nitro group at the 6-position of the benzimidazole structure, contributing to its unique chemical properties. It is typically a crystalline solid, exhibiting moderate solubility in organic solvents while being less soluble in water. The presence of the nitro group imparts electrophilic characteristics, making it reactive in various chemical reactions, including nucleophilic substitutions. This compound is of interest in medicinal chemistry and material science due to its potential biological activities and applications. Additionally, its stability under standard conditions allows for its use in various synthetic pathways. Safety data indicates that, like many nitro compounds, it should be handled with care due to potential toxicity and environmental impact. Overall, 2-Ethyl-6-nitro-1H-benzimidazole is a versatile compound with significant implications in research and industry.

Formula: C₉H₉N₃O₂

InChI: InChI=1S/C9H9N3O2/c1-2-9-10-7-4-3-6(12(13)14)5-8(7)11-9/h3-5H,2H2,1H3,(H,10,11)

InChI key: InChIKey=AAJAEEPAUQTYFB-UHFFFAOYSA-N

SMILES: N(=O)(=O)C=1C=C2C(N=C(CC)N2)=CC1

Synonyms:

• 1H-benzimidazole, 2-ethyl-5-nitro-
• 1H-benzimidazole, 2-ethyl-6-nitro-
• 2-Ethyl-5-nitro-1H-1,3-benzodiazole
• 2-Ethyl-5-nitro-1H-benzimidazole
• 2-Ethyl-5-nitro-1H-benzo[d]imidazole
• 2-Ethyl-5-nitrobenzimidazole
• 2-Ethyl-6-nitro-1H-1,3-benzodiazole
• Benzimidazole, 2-ethyl-5(or 6)-nitro-
• Benzimidazole, 2-ethyl-5-nitro-
• NSC 49474
• 2-Ethyl-6-nitro-1H-benzimidazole

2-Ethyl-6-nitro-1H-1,3-benzodiazole

CAS: 5805-42-5

Versatile small molecule scaffold

Formula: C₉H₉N₃O₂

Purity: Min. 95%

Molecular weight: 191.19 g/mol

Ref: 3D-FAA80542