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Atomfair 1-Nitro-2-(trifluoromethoxy)benzene C7H4F3NO3 CAS 1644-88-8

1-Nitro-2-(trifluoromethoxy)benzene (CAS No. 1644-88-8) is a high-purity specialty chemical with the molecular formula C7H4F3NO3. This aromatic nitro compound features a trifluoromethoxy (–OCF3) substituent, offering unique electronic and steric properties for advanced synthetic applications. Ideal for pharmaceutical intermediates, agrochemical research, and materials science, our product is rigorously tested to ensure ≥98% purity (GC) with trace metal analysis available upon request. Supplied in amber glass vials under inert gas to prevent degradation. SDS and analytical certificates included.

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Description

1-Nitro-2-(trifluoromethoxy)benzene (CAS No. 1644-88-8) is a high-purity specialty chemical with the molecular formula C7H4F3NO3. This aromatic nitro compound features a trifluoromethoxy (–OCF3) substituent, offering unique electronic and steric properties for advanced synthetic applications. Ideal for pharmaceutical intermediates, agrochemical research, and materials science, our product is rigorously tested to ensure ≥98% purity (GC) with trace metal analysis available upon request. Supplied in amber glass vials under inert gas to prevent degradation. SDS and analytical certificates included.

Properties

  • CAS Number: 1644-88-8
  • Complexity: 213
  • IUPAC Name: 1-nitro-2-(trifluoromethoxy)benzene
  • InChI: InChI=1S/C7H4F3NO3/c8-7(9,10)14-6-4-2-1-3-5(6)11(12)13/h1-4H
  • InChI Key: YTWBYJAWWKTPOV-UHFFFAOYSA-N
  • Exact Mass: 207.01432748
  • Molecular Formula: C7H4F3NO3
  • Molecular Weight: 207.11
  • SMILES: C1=CC=C(C(=C1)[N+](=O)[O-])OC(F)(F)F
  • Topological: 55.1
  • Monoisotopic Mass: 207.01432748
  • Synonyms: 1-nitro-2-(trifluoromethoxy)benzene, 1644-88-8, DTXSID30500942, DTXCID20451752, 2-(trifluoromethoxy)nitrobenzene, Benzene, 1-nitro-2-(trifluoromethoxy)-, MFCD00041010, O-nitrotrifluoromethoxybenzene, 1-Nitro-2-(trifluoromethoxy)benzene; alpha,alpha,alpha-trifluoro-o-nitroanisole; 1-Nitro-2-[(trifluoromethyl)oxy]benzene;, trifluoromethoxynitrobenzene, 2-trifluoromethoxy-nitrobenzene, SCHEMBL6112961, SCHEMBL8072962, SCHEMBL10813870, SCHEMBL10819050, SCHEMBL16959165, SBB063444, AKOS005145715, AC-9726, CS-W015277, AS-17677, SY019044

Application

1-Nitro-2-(trifluoromethoxy)benzene serves as a key building block in electrophilic aromatic substitution reactions for pharmaceutical derivatization. Its electron-withdrawing –NO2 and –OCF3 groups enable precise regiocontrol in cross-coupling reactions. Researchers utilize this compound in the development of fluorinated liquid crystals and energetic materials. The trifluoromethoxy moiety enhances metabolic stability in drug candidate screening.

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

Disclaimer

Intended Use & Restrictions

This product is sold exclusively for laboratory research, analytical testing, or non-commercial purposes.

  • Strictly prohibited: Resale, repackaging, or formulation into commercial products.
  • Not approved for human/animal use, diagnostics, or manufacturing (including pharmaceuticals, agrochemicals, or consumer goods).

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Certain molecules may be protected by active patents or regulatory restrictions.

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  • Atomfair LLC does not provide legal assurances regarding patent non-infringement or jurisdictional compliance.

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  • Use this product only as permitted by law.
  • Indemnify Atomfair LLC against all claims arising from misuse, patent infringement, or regulatory violations.

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