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Atomfair Methyl 4-acetyl-2-methylbenzoate C11H12O3 CAS 1036715-60-2

Methyl 4-acetyl-2-methylbenzoate (CAS No. 1036715-60-2) is a high-purity organic compound with the molecular formula C11H12O3. This ester derivative features both acetyl and methyl ester functional groups on a benzene ring, making it a valuable intermediate in synthetic organic chemistry and pharmaceutical research. Its well-defined structure (IUPAC name: methyl 4-acetyl-2-methylbenzoate) ensures consistent reactivity in nucleophilic substitutions, condensations, and other key transformations. Available in >95% purity (HPLC/GC), it is supplied in sealed packaging under inert gas to prevent degradation. Ideal for use in: Method development in analytical chemistry Building block for heterocyclic synthesis Material science applications Pharmaceutical impurity profiling Technical data including1H/13C…

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Description

Methyl 4-acetyl-2-methylbenzoate (CAS No. 1036715-60-2) is a high-purity organic compound with the molecular formula C11H12O3. This ester derivative features both acetyl and methyl ester functional groups on a benzene ring, making it a valuable intermediate in synthetic organic chemistry and pharmaceutical research. Its well-defined structure (IUPAC name: methyl 4-acetyl-2-methylbenzoate) ensures consistent reactivity in nucleophilic substitutions, condensations, and other key transformations. Available in >95% purity (HPLC/GC), it is supplied in sealed packaging under inert gas to prevent degradation. Ideal for use in:

  • Method development in analytical chemistry
  • Building block for heterocyclic synthesis
  • Material science applications
  • Pharmaceutical impurity profiling

Technical data including 1H/13C NMR spectra and MSDS are available upon request.

Properties

  • CAS Number: 1036715-60-2
  • Complexity: 235
  • IUPAC Name: methyl 4-acetyl-2-methyl-benzoate
  • InChI: InChI=1S/C11H12O3/c1-7-6-9(8(2)12)4-5-10(7)11(13)14-3/h4-6H,1-3H3
  • InChI Key: JPGRRURDXMILEX-UHFFFAOYSA-N
  • Exact Mass: 192.078644241
  • Molecular Formula: C11H12O3
  • Molecular Weight: 192.21
  • SMILES: CC1=C(C=CC(=C1)C(=O)C)C(=O)OC
  • Topological: 43.4
  • Monoisotopic Mass: 192.078644241
  • Synonyms: methyl 4-acetyl-2-methylbenzoate, 1036715-60-2, SCHEMBL3117994, LRB71560, DA-32524, CS-0181026, EN300-1866713, A1-10211, Z1862015875

Application

Methyl 4-acetyl-2-methylbenzoate serves as a versatile synthon in medicinal chemistry for constructing fused ring systems. Researchers employ it as a precursor in the synthesis of potential kinase inhibitors due to its acetylbenzene motif. The compound’s dual functionality allows simultaneous modification at both the ketone and ester groups, enabling combinatorial library development. It has shown utility in non-linear optical material research owing to its conjugated aromatic system.

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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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