Description

1-Cyclopropyl-4-nitronaphthalene (CAS No. 878671-93-3) is a high-purity organic compound with the molecular formula C₁₃H₁₁NO₂. This nitronaphthalene derivative features a cyclopropyl substituent at the 1-position and a nitro group at the 4-position, making it a valuable intermediate in synthetic organic chemistry and materials science. With a molecular weight of 213.23 g/mol, this compound is ideal for researchers developing novel pharmaceuticals, agrochemicals, or optoelectronic materials. Available in quantities ranging from milligrams to kilograms, our product is rigorously tested for purity (typically ≥95% by HPLC or GC analysis) and comes with comprehensive analytical data, including ¹H NMR, ¹³C NMR, and mass spectrometry. Proper storage at 2-8°C under inert atmosphere ensures long-term stability.

Properties

• CAS Number: 878671-93-3
• Complexity: 282
• IUPAC Name: 1-cyclopropyl-4-nitro-naphthalene
• InChI: InChI=1S/C13H11NO2/c15-14(16)13-8-7-10(9-5-6-9)11-3-1-2-4-12(11)13/h1-4,7-9H,5-6H2
• InChI Key: CHOXFKFUEGIWTO-UHFFFAOYSA-N
• Exact Mass: 213.078978594
• Molecular Formula: C13H11NO2
• Molecular Weight: 213.23
• SMILES: C1CC1C2=CC=C(C3=CC=CC=C23)[N+](=O)[O-]
• Topological: 45.8
• Monoisotopic Mass: 213.078978594
• Synonyms: 1-cyclopropyl-4-nitronaphthalene, 878671-93-3, SCHEMBL247798, 1-cyclopropyl-4-nitro-naphthalene, CHOXFKFUEGIWTO-UHFFFAOYSA-N, AC-31189, AS-83393, DB-216081

Application

1-Cyclopropyl-4-nitronaphthalene serves as a versatile building block in medicinal chemistry for the synthesis of potential drug candidates, particularly in the development of kinase inhibitors or antimicrobial agents. The compound’s unique structure makes it valuable in materials science for creating organic semiconductors or fluorescent probes. Researchers also utilize it as a precursor in palladium-catalyzed cross-coupling reactions to construct more complex polycyclic aromatic systems.

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