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CS-W001157 4
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Methyl 2-(m-tolyl)acetate

  • CAS No. 53088-69-0

  • Cat. No. CS-0088535
  • Molecule weight164.20
  • Purity≥97%
  • MDL No.MFCD00968468

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

Methyl 2-(m-tolyl)acetate|CS-0088535

Structure of 53088-69-0

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General Information

  • CAS No. 53088-69-0
  • Cat. No. CS-0088535
  • Purity ≥97%
  • MDL No. MFCD00968468
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₂O₂
  • Molecular Weight 164.20
  • Synonym(s) METHYL M-TOLYLACETATE
  • SMILES O=C(OC)CC1=CC=CC(C)=C1

Description

Methyl 2-(m-tolyl)acetate is a bench-stable, moisture-tolerant ester featuring a para-methylphenyl group that imparts enhanced solubility in organic solvents. This aryl-substituted acetic acid derivative integrates readily into coupling reactions and serves as a key intermediate in synthesizing bioactive molecules and functional polymers under standard conditions.

Application

Methyl 2-(m-tolyl)acetate serves as a versatile synthetic intermediate for constructing biologically relevant arylalkyl motifs. The methyl ester group enables straightforward manipulation via hydrolysis, reduction, or coupling reactions, while the meta-tolyl substituent provides steric and electronic modulation. It functions reliably in Pd-catalyzed cross-coupling protocols and acts as a key building block for heterocyclic systems and pharmaceutical scaffolds.

Synthesis

  • Route1
    • null|null
      67-56-1
    • In-stock
      m-Tolylacetic acid|CS-0046111
      621-36-3
    • ~98%
    • In-stock
      Methyl 2-(m-tolyl)acetate|CS-0088535
      53088-69-0

    References

    • Journal of Medicinal Chemistry, , vol. 53, # 7 p. 2964 - 2972
  • Route2
    • In-stock
      m-Tolylacetic acid|CS-0046111
      621-36-3
    • null|null
      18107-18-1
    • ~%
    • In-stock
      Methyl 2-(m-tolyl)acetate|CS-0088535
      53088-69-0

    References

    • WO2007/51062 A2, ; Page/Page column 143 ; WO 2007/051062 A2
  • Route3
    • null|null
      126889-61-0
    • null|null
      124-41-4
    • ~%
    • In-stock
      Methyl 2,4-dimethylbenzoate|CS-0153337
      23617-71-2
    • In-stock
      Methyl 2-(m-tolyl)acetate|CS-0088535
      53088-69-0

    References

    • Helvetica Chimica Acta, , vol. 81, # 2 p. 251 - 267

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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   1.71052
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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