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CS-W001157 4
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Triallyl benzene-1,2,4-tricarboxylate,98% (stabilized with TBC)

  • CAS No. 2694-54-4

  • Cat. No. CS-0157983
  • Molecule weight330.33
  • Purity97% (stabilized with TBC)
  • MDL No.MFCD00080653

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

Triallyl benzene-1,2,4-tricarboxylate,98% (stabilized with TBC)|CS-0157983

Structure of 2694-54-4

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General Information

  • CAS No. 2694-54-4
  • Cat. No. CS-0157983
  • Purity 97% (stabilized with TBC)
  • MDL No. MFCD00080653
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₈H₁₈O₆
  • Molecular Weight 330.33
  • Synonym(s) triprop-2-en-1-yl benzene-1,2,4-tricarboxylate
  • SMILES C=CCOC(=O)C1=CC(=C(C=C1)C(=O)OCC=C)C(=O)OCC=C

Description

Triallyl benzene-1,2,4-tricarboxylate, stabilized with TBC, features three allyl ester groups flanking a benzene core, enabling efficient Diels-Alder cycloadditions. This bench-stable reagent integrates readily into polymer networks and functional materials, offering high reactivity under mild conditions with minimal side reactions.

Application

Triallyl benzene-1,2,4-tricarboxylate serves as a versatile tri-functional building block for C–C coupling and heterocycle synthesis, offering high stability under standard bench conditions due to stabilization with TBC. Its allyl ester groups enable selective transformations via Pd-catalyzed reactions, facilitating efficient access to complex architectures in medicinal chemistry and materials science workflows.

Safety Information

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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

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Computational Chemistry Data

  • TPSA   78.9
  • LogP   2.715
  • H_Acceptors   6
  • H_Donors   0
  • Rotatable_Bonds   9

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