Description

1,3-Dibromo-5-nitrobenzene (CAS No. 6311-60-0) is a high-purity aromatic compound with the molecular formula C₆H₃Br₂NO₂. This halogenated nitrobenzene derivative is widely utilized in organic synthesis, pharmaceutical research, and material science due to its reactive bromine and nitro functional groups. Its crystalline solid form ensures stability and ease of handling in laboratory settings. Ideal for use as an intermediate in the preparation of advanced chemical compounds, 1,3-Dibromo-5-nitrobenzene is rigorously tested for purity (>98%) and consistency, meeting the stringent requirements of researchers and industrial applications. Each batch is supplied with comprehensive analytical documentation, including GC/MS, HPLC, and NMR data, to guarantee quality and traceability.

Properties

• CAS Number: 6311-60-0
• Complexity: 149
• IUPAC Name: 1,3-dibromo-5-nitro-benzene
• InChI: InChI=1S/C6H3Br2NO2/c7-4-1-5(8)3-6(2-4)9(10)11/h1-3H
• InChI Key: ZWBHGBWABMAWOV-UHFFFAOYSA-N
• Exact Mass: 280.85100
• Molecular Formula: C6H3Br2NO2
• Molecular Weight: 280.90
• SMILES: C1=C(C=C(C=C1Br)Br)[N+](=O)[O-]
• Topological: 45.8
• Monoisotopic Mass: 278.85305
• Synonyms: 1,3-dibromo-5-nitrobenzene, Benzene, 1,3-dibromo-5-nitro-, DTXSID60285917, DTXCID10237067, 636-300-9, zwbhgbwabmawov-uhfffaoysa-n, 6311-60-0, 3,5-Dibromonitrobenzene, 3,5-Dibromonitro benzene, MFCD00092529, NSC43228, Dibromo-5-nitrobenzene, 3,5-dibromo nitrobenzene, 3,5-dibromo-nitro-benzene, SCHEMBL219410, SCHEMBL909638, 1,3-Dibromo-5-nitro-benzene, SCHEMBL11750501, NSC-43228, AKOS005067862, CS-W001101, AC-29799, AS-18026, SY026642, DB-058101, D5383, EN300-113111

1,3-Dibromo-5-nitrobenzene serves as a versatile building block in organic synthesis, particularly in the preparation of pharmaceuticals and agrochemicals. Its bromine atoms enable efficient cross-coupling reactions, such as Suzuki or Heck couplings, while the nitro group facilitates further functionalization. Researchers also employ this compound in the development of liquid crystals and specialty polymers. It is commonly used in academic and industrial labs for exploring novel heterocyclic frameworks. Proper handling under inert conditions is recommended due to its reactivity.

Safety and Hazards

GHS Hazard Statements

• H302 (93%): Harmful if swallowed [Warning Acute toxicity, oral]

Precautionary Statements

• P264, P270, P301+P317, P330, and P501

Hazard Classes and Categories

• Acute Tox. 4 (93%)

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