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4',4''',4''''',4'''''''-(Ethene-1,1,2,2-tetrayl)tetrakis(([1,1'-biphenyl]-4-carboxylic acid))

  • CAS No. 1610858-96-2

  • Cat. No. CS-0110061
  • Purity≥97%
  • MDL No.MFCD30537426

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

4',4''',4''''',4'''''''-(Ethene-1,1,2,2-tetrayl)tetrakis(([1,1'-biphenyl]-4-carboxylic acid))|CS-0110061

Structure of 1610858-96-2

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General Information

  • CAS No. 1610858-96-2
  • Cat. No. CS-0110061
  • Purity ≥97%
  • MDL No. MFCD30537426
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅₄H₃₆O₈
  • Molecular Weight 812.87
  • Synonym(s) None
  • SMILES O=C(O)C1=CC=C(C=C1)C2=CC=C(C=C2)C(C3=CC=C(C=C3)C4=CC=C(C=C4)C(=O)O)=C(C5=CC=C(C=C5)C6=CC=C(C=C6)C(=O)O)C7=CC=C(C=C7)C8=CC=C(C=C8)C(=O)O

Description

This tetracarboxylic acid features four biphenylcarboxylate units linked via a central ethene-tetrayl backbone, delivering high rigidity and extended π-conjugation. The structure enables robust coordination in metal-organic frameworks and facilitates precise spatial control in supramolecular assemblies.

Application

4',4''',4''''',4'''''''-(Ethene-1,1,2,2-tetrayl)tetrakis([1,1'-biphenyl]-4-carboxylic acid) serves as a versatile tetracarboxylic ligand for metal coordination and supramolecular assembly. Its rigid, rod-like architecture enables precise spatial control in complex architectures, while the biphenyl moieties enhance π-stacking interactions. The molecule exhibits excellent bench stability and facilitates straightforward purification via recrystallization, making it well-suited for modular synthesis of functionalized materials and coordination polymers.

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   149.2
  • LogP   12.1548
  • H_Acceptors   4
  • H_Donors   4
  • Rotatable_Bonds   12

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