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CS-W001157 4
Total: USD 88.00

1,2,3-Trichloro-4-methylbenzene

  • CAS No. 7359-72-0

  • Cat. No. CS-0061134
  • Molecule weightNone
  • Purity≥97%
  • MDL No.MFCD00018098

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

1,2,3-Trichloro-4-methylbenzene|CS-0061134

Structure of 7359-72-0

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General Information

  • CAS No. 7359-72-0
  • Cat. No. CS-0061134
  • Purity ≥97%
  • MDL No. MFCD00018098
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₅Cl₃
  • Molecular Weight None
  • Synonym(s) 2,3,4-Trichlorotoluene
  • SMILES CC1=C(C(=C(C=C1)Cl)Cl)Cl

Description

1,2,3-Trichloro-4-methylbenzene features a methyl-substituted aromatic core with three adjacent chlorine atoms, delivering high reactivity in electrophilic substitution and serving as a key intermediate in the synthesis of specialty agrochemicals and pharmaceuticals. The ortho-chlorine arrangement enhances steric influence, while the para-methyl group provides electronic stabilization.

Application

1,2,3-Trichloro-4-methylbenzene serves as a versatile building block in synthetic organic chemistry, enabling the construction of substituted aromatic systems through palladium-catalyzed cross-coupling reactions. The methyl group provides a site for oxidation or functionalization, while the trichloro substitution pattern offers controlled reactivity in electrophilic aromatic substitution and metal-mediated transformations. Its bench-stable nature and compatibility with standard purification methods make it well-suited for use in medicinal chemistry and process development workflows.

Safety Information

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Computational Chemistry Data

  • TPSA   0
  • LogP   3.95522
  • H_Acceptors   0
  • H_Donors   0
  • Rotatable_Bonds   0

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