Description
4,7-Dibromo-2-(2-ethylhexyl)-5,6-dinitro-2H-benzo[d][1,2,3]triazole (CAS: 1613460-25-5) is a high-purity, nitro-functionalized benzotriazole derivative with a molecular formula of C14H17Br2N5O4. This compound features a dibrominated and dinitro-substituted benzotriazole core, coupled with a 2-ethylhexyl side chain, offering unique electronic and steric properties. Ideal for advanced research in organic electronics, photovoltaics, and materials science, this compound is rigorously tested for consistency and purity. Packaged under inert conditions to ensure stability, it is suited for use as a building block in the synthesis of conjugated polymers, small-molecule semiconductors, or as a functional dopant. Available in milligram to gram quantities with customizable packaging options.
Properties
- CAS Number: 1613460-25-5
- Complexity: 455
- IUPAC Name: 4,7-dibromo-2-(2-ethylhexyl)-5,6-dinitro-benzotriazole
- InChI: InChI=1S/C14H17Br2N5O4/c1-3-5-6-8(4-2)7-19-17-11-9(15)13(20(22)23)14(21(24)25)10(16)12(11)18-19/h8H,3-7H2,1-2H3
- InChI Key: KLAVNVCAWIFHAJ-UHFFFAOYSA-N
- Exact Mass: 478.96268
- Molecular Formula: C14H17Br2N5O4
- Molecular Weight: 479.12
- SMILES: CCCCC(CC)CN1N=C2C(=C(C(=C(C2=N1)Br)[N+](=O)[O-])[N+](=O)[O-])Br
- Topological: 122
- Monoisotopic Mass: 476.96473
- Synonyms: 4,7-dibromo-2-(2-ethylhexyl)-5,6-dinitro-2H-benzo[d][1,2,3]triazole, BTZ2NO226-2Br, SCHEMBL29091361, ZB0851, 1613460-25-5
Application
This compound is primarily used as a key intermediate in the synthesis of high-performance organic electronic materials, such as organic light-emitting diodes (OLEDs) and organic photovoltaics (OPVs). Its nitro and bromo functional groups enable efficient cross-coupling reactions for constructing π-conjugated systems. Researchers also explore its potential as an electron-accepting moiety in donor-acceptor polymers for optoelectronic applications. Additionally, it may serve as a precursor for photoactive or redox-active materials in energy storage devices.
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