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5'-(3,5-Dicarboxyphenyl)-[1,1':3',1''-terphenyl]-3,3'',5,5''-tetracarboxylic acid

  • CAS No. 1228047-99-1

  • Cat. No. CS-0110058
  • Purity≥95%
  • MDL No.MFCD30541554

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

5'-(3,5-Dicarboxyphenyl)-[1,1':3',1''-terphenyl]-3,3'',5,5''-tetracarboxylic acid|CS-0110058

Structure of 1228047-99-1

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General Information

  • CAS No. 1228047-99-1
  • Cat. No. CS-0110058
  • Purity ≥95%
  • MDL No. MFCD30541554
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₃₀H₁₈O₁₂
  • Molecular Weight 570.46
  • Synonym(s) None
  • SMILES O=C(O)C=1C=C(C=C(C1)C2=CC(=CC(=C2)C=3C=C(C=C(C3)C(=O)O)C(=O)O)C=4C=C(C=C(C4)C(=O)O)C(=O)O)C(=O)O

Description

This terphenyl-based polycarboxylic acid features four carboxylic acid groups positioned at the 3,3'',5,5''-sites and a central 3,5-dicarboxyphenyl substituent, enabling robust metal coordination. The extended π-conjugated core enhances electronic delocalization, while the carboxylate functionality supports integration into metal-organic frameworks or surface-functionalized materials under standard conditions.

Application

5'-(3,5-Dicarboxyphenyl)-[1,1':3',1''-terphenyl]-3,3'',5,5''-tetracarboxylic acid serves as a versatile, multi-carboxylated building block for constructing extended π-conjugated architectures. Its robust bench stability and orthogonal carboxylic acid functionality enable reliable coupling in metal-mediated cross-coupling reactions and coordination-driven self-assembly. The molecule facilitates precise control over molecular geometry in materials science applications, particularly in the development of functionalized organic frameworks and optoelectronic scaffolds.

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-P280-P302+P352

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Computational Chemistry Data

  • TPSA   223.8
  • LogP   4.8768
  • H_Acceptors   6
  • H_Donors   6
  • Rotatable_Bonds   9

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