Description

4-methyl-1-(3-nitro-5-(trifluoromethyl)phenyl)-1H-imidazole (CAS No. 916975-92-3) is a high-purity heterocyclic compound featuring an imidazole core substituted with a methyl group at the 4-position and a 3-nitro-5-(trifluoromethyl)phenyl moiety at the 1-position. With the molecular formula C₁₁H₈F₃N₃O₂, this compound is characterized by its nitro and trifluoromethyl functional groups, which enhance its reactivity and potential utility in synthetic chemistry. Ideal for researchers and scientists, this product is rigorously tested for quality and consistency, ensuring reliable performance in advanced applications. Suitable for use in pharmaceutical intermediates, agrochemical research, and material science, this compound is available in various quantities to meet your laboratory needs.

Properties

• CAS Number: 916975-92-3
• Complexity: 345
• IUPAC Name: 4-methyl-1-[3-nitro-5-(trifluoromethyl)phenyl]imidazole
• InChI: InChI=1S/C11H8F3N3O2/c1-7-5-16(6-15-7)9-2-8(11(12,13)14)3-10(4-9)17(18)19/h2-6H,1H3
• InChI Key: JMLCVCGQBRZYOZ-UHFFFAOYSA-N
• Exact Mass: 271.05686099
• Molecular Formula: C11H8F3N3O2
• Molecular Weight: 271.19
• SMILES: CC1=CN(C=N1)C2=CC(=CC(=C2)C(F)(F)F)[N+](=O)[O-]
• Topological: 63.6
• Monoisotopic Mass: 271.05686099
• Synonyms: 916975-92-3, 4-Methyl-1-(3-nitro-5-(trifluoromethyl)phenyl)-1H-imidazole, 4-Methyl-1-[3-nitro-5-(trifluoromethyl)phenyl]-1H-imidazole, DTXSID80589949, EC 700-566-5, DTXCID40540713, 700-566-5, 1H-Imidazole, 4-methyl-1-[3-nitro-5-(trifluoromethyl)phenyl]-, 4-METHYL-1-[3-NITRO-5-(TRIFLUOROMETHYL)PHENYL]IMIDAZOLE, 4-methyl-1-(3-nitro-5-trifluoromethyl-phenyl)-1H-imidazole, BR76KC6BSK, SCHEMBL1505909, AKOS016013452, DB-358363, NS00006751

Application

4-methyl-1-(3-nitro-5-(trifluoromethyl)phenyl)-1H-imidazole is primarily used as a key intermediate in the synthesis of pharmaceuticals and agrochemicals due to its reactive nitro and trifluoromethyl groups. Its unique structure makes it valuable in the development of novel bioactive compounds and catalysts. Researchers also explore its potential in material science for designing advanced polymers and coatings with specialized properties.

Safety and Hazards

GHS Hazard Statements

• H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
• H411 (100%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

Precautionary Statements

• P264, P270, P273, P301+P316, P321, P330, P391, P405, and P501

Hazard Classes and Categories

• Acute Tox. 3 (100%)
• Aquatic Chronic 2 (100%)

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Disclaimer: Sold exclusively for laboratory research. Prohibited for commercial use, diagnostics, or human/animal applications. Buyers assume all compliance liability.