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CS-W001157 4
Total: USD 88.00

1-(3,4-Dimethylphenyl)ethanone

  • CAS No. 3637-01-2

  • Cat. No. CS-W014398
  • Purity≥98%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

1-(3,4-Dimethylphenyl)ethanone|CS-W014398

Structure of 3637-01-2

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General Information

  • CAS No. 3637-01-2
  • Cat. No. CS-W014398
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₂O
  • Molecular Weight 148.21
  • Synonym(s) 3',4'-Dimethylacetophenone
  • SMILES CC(C1=CC=C(C)C(C)=C1)=O

Description

3,4-Dimethylacetophenone was used as starting reagent in the synthesis of 4-[5-(3,4-dimethylphenyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl]benzenecarboxyamide.

Application

1-(3,4-Dimethylphenyl)ethanone serves as a versatile aryl ketone building block in synthetic organic chemistry, enabling efficient construction of biaryl and heterocyclic scaffolds. Its ortho-dimethyl substitution enhances stability and modulates reactivity, facilitating electrophilic aromatic substitution and transition-metal-catalyzed coupling reactions. The compound exhibits excellent bench stability, ease of purification, and compatibility with diverse functional groups, making it a reliable intermediate for medicinal chemistry and process development workflows.

Synthesis

  • Route1
    • null|null
      95-47-6
    • null|null
      108-24-7
    • ~87%
    • In-stock
      1-(3,4-Dimethylphenyl)ethanone|CS-W014398
      3637-01-2

    References

    • Tetrahedron Letters, , vol. 36, # 3 p. 409 - 412
  • Route2
    • null|null
      6196-95-8
    • ~3%
    • null|null
      95-65-8
    • In-stock
      Acetophenone|CS-0015982
      98-86-2
    • In-stock
      1-(3,4-Dimethylphenyl)ethanone|CS-W014398
      3637-01-2
    • null|null
      108-95-2

    References

    • EP1967505 A1, ; Page/Page column 14 ;
  • Route3
    • null|null
      95-47-6
    • null|null
      75-36-5
    • ~93%
    • In-stock
      1-(3,4-Dimethylphenyl)ethanone|CS-W014398
      3637-01-2

    References

    • Advanced Synthesis and Catalysis, , vol. 352, # 17 p. 3031 - 3044

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   2.50604
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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