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Atomfair 2-Formyl-4,5-dimethoxybenzonitrile C10H9NO3 CAS 1013112-48-5

2-Formyl-4,5-dimethoxybenzonitrile (CAS No. 1013112-48-5) is a high-purity organic compound with the molecular formula C10H9NO3. This aromatic nitrile derivative features a formyl group and two methoxy substituents, making it a versatile intermediate for synthetic chemistry applications. With a molecular weight of 191.18 g/mol, it is ideal for researchers in pharmaceuticals, agrochemicals, and material science. The compound is supplied as a fine powder or crystalline solid, ensuring consistent reactivity and ease of handling. Store in a cool, dry place away from light to maintain stability. Purity is guaranteed ≥95% by HPLC, with detailed analytical data available upon request.

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Description

2-Formyl-4,5-dimethoxybenzonitrile (CAS No. 1013112-48-5) is a high-purity organic compound with the molecular formula C10H9NO3. This aromatic nitrile derivative features a formyl group and two methoxy substituents, making it a versatile intermediate for synthetic chemistry applications. With a molecular weight of 191.18 g/mol, it is ideal for researchers in pharmaceuticals, agrochemicals, and material science. The compound is supplied as a fine powder or crystalline solid, ensuring consistent reactivity and ease of handling. Store in a cool, dry place away from light to maintain stability. Purity is guaranteed ≥95% by HPLC, with detailed analytical data available upon request.

Properties

  • CAS Number: 1013112-48-5
  • Complexity: 245
  • IUPAC Name: 2-formyl-4,5-dimethoxy-benzonitrile
  • InChI: InChI=1S/C10H9NO3/c1-13-9-3-7(5-11)8(6-12)4-10(9)14-2/h3-4,6H,1-2H3
  • InChI Key: YNEXSTHJDYEIIP-UHFFFAOYSA-N
  • Exact Mass: 191.058243149
  • Molecular Formula: C10H9NO3
  • Molecular Weight: 191.18
  • SMILES: COC1=C(C=C(C(=C1)C=O)C#N)OC
  • Topological: 59.3
  • Monoisotopic Mass: 191.058243149
  • Synonyms: 2-formyl-4,5-dimethoxybenzonitrile, 1013112-48-5, Benzonitrile, 2-formyl-4,5-dimethoxy-, 4,5-Dimethoxy-2-formylbenzonitrile, SCHEMBL585015, YNEXSTHJDYEIIP-UHFFFAOYSA-N, AKOS027250596, DS-11469, 2-Formyl-4 pound not5-dimethoxybenzonitrile, CS-0161342, C71068

Application

2-Formyl-4,5-dimethoxybenzonitrile is widely used as a key intermediate in the synthesis of heterocyclic compounds and active pharmaceutical ingredients (APIs). Its reactive formyl and nitrile groups enable participation in condensation, cyclization, and nucleophilic addition reactions. Researchers employ it in the development of novel dyes, ligands, and catalysts. The dimethoxy substitution pattern enhances its utility in designing CNS-targeting drug candidates.

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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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  • 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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