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CS-W001157 4
Total: USD 88.00

N-(o-Tolyl)acetamide

  • CAS No. 120-66-1

  • Cat. No. CS-0152950
  • Purity≥98%
  • MDL No.MFCD00014961

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

N-(o-Tolyl)acetamide|CS-0152950

Structure of 120-66-1

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General Information

  • CAS No. 120-66-1
  • Cat. No. CS-0152950
  • Purity ≥98%
  • MDL No. MFCD00014961
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₁NO
  • Molecular Weight 149.19
  • Synonym(s) o-Acetotoluidide
  • SMILES CC1=CC=CC=C1NC(C)=O

Description

N-(o-Tolyl)acetamide features a benzene ring substituted with both a methyl and acetamide group in ortho orientation, creating a sterically constrained, electron-rich aromatic system. This configuration enhances solubility in organic solvents while maintaining bench stability. The compound serves as a key scaffold in medicinal chemistry for designing kinase inhibitors and bioactive heterocycles due to its ability to integrate into diverse molecular frameworks under standard conditions.

Application

N-(o-Tolyl)acetamide serves as a versatile building block in medicinal chemistry, enabling efficient access to substituted anilines and heterocyclic scaffolds. Its ortho-tolyl group provides steric and electronic modulation, while the acetamide functionality offers stability and compatibility with standard transformations such as reduction, coupling, and electrophilic substitution. The compound exhibits excellent bench stability, ease of purification, and broad functional group tolerance, making it well-suited for iterative synthesis workflows and API intermediate development.

Synthesis

  • Route1
    • null|null
      75-36-5
    • null|null
      95-53-4
    • ~85%
    • In-stock
      N-(o-Tolyl)acetamide|CS-0152950
      120-66-1

    References

    • WO2012/59232 A1, ; Page/Page column 57 ;
  • Route2

    References

    • Synlett, , # 9 p. 1517 - 1520
  • Route3
    • null|null
      108-24-7
    • null|null
      95-53-4
    • ~95%
    • In-stock
      N-(o-Tolyl)acetamide|CS-0152950
      120-66-1

    References

    • Chemical Communications, , # 6 p. 764 - 765

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H318
Precautionary Statements : P264-P270-P280-P305+P351+P338-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   29.1
  • LogP   1.95342
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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