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Atomfair 3-(5-Chloro-2-methoxy-3-nitrophenyl)-1-methyl-1H-1,2,4-triazole C10H9ClN4O3 CAS 2245111-21-9

3-(5-Chloro-2-methoxy-3-nitrophenyl)-1-methyl-1H-1,2,4-triazole (CAS No. 2245111-21-9) is a high-purity heterocyclic compound with the molecular formula C10H9ClN4O3. This specialized chemical features a 1,2,4-triazole core substituted with a chloro-methoxy-nitrophenyl group, making it a valuable intermediate for pharmaceutical and agrochemical research. Its unique structure enables applications in medicinal chemistry, particularly in the development of novel bioactive molecules. The compound is supplied as a solid with verified analytical data (HPLC, NMR, MS) to ensure consistency and reliability for your experiments. Store in a cool, dry place under inert conditions to maintain stability.

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Description

3-(5-Chloro-2-methoxy-3-nitrophenyl)-1-methyl-1H-1,2,4-triazole (CAS No. 2245111-21-9) is a high-purity heterocyclic compound with the molecular formula C10H9ClN4O3. This specialized chemical features a 1,2,4-triazole core substituted with a chloro-methoxy-nitrophenyl group, making it a valuable intermediate for pharmaceutical and agrochemical research. Its unique structure enables applications in medicinal chemistry, particularly in the development of novel bioactive molecules. The compound is supplied as a solid with verified analytical data (HPLC, NMR, MS) to ensure consistency and reliability for your experiments. Store in a cool, dry place under inert conditions to maintain stability.

Properties

  • CAS Number: 2245111-21-9
  • Complexity: 314
  • IUPAC Name: 3-(5-chloro-2-methoxy-3-nitro-phenyl)-1-methyl-1,2,4-triazole
  • InChI: InChI=1S/C10H9ClN4O3/c1-14-5-12-10(13-14)7-3-6(11)4-8(15(16)17)9(7)18-2/h3-5H,1-2H3
  • InChI Key: SSLNNYAYKIRANI-UHFFFAOYSA-N
  • Exact Mass: 268.0363179
  • Molecular Formula: C10H9ClN4O3
  • Molecular Weight: 268.65
  • SMILES: CN1C=NC(=N1)C2=C(C(=CC(=C2)Cl)[N+](=O)[O-])OC
  • Topological: 85.8
  • Monoisotopic Mass: 268.0363179
  • Synonyms: 3-(5-Chloro-2-methoxy-3-nitrophenyl)-1-methyl-1H-1,2,4-triazole, 2245111-21-9, SCHEMBL22280364, MFCD32876765, SY277150

Application

This compound serves as a key building block in the synthesis of triazole-containing pharmaceuticals, particularly for antimicrobial and antifungal agents. Researchers utilize it in structure-activity relationship (SAR) studies to optimize drug candidates targeting enzyme inhibition. It may also find use in material science for the development of nitrogen-rich energetic materials.

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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).

Patent & Regulatory Compliance

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

  • Buyers must independently verify patent status (e.g., via USPTO/EPO/CNIPA) and comply with local laws.
  • Atomfair LLC does not provide legal assurances regarding patent non-infringement or jurisdictional compliance.

Liability Release

By purchasing, the buyer agrees to:

  • 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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