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CS-W001157 4
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3-Hydroxy-[1,1'-biphenyl]-4,4'-dicarbonitrile

  • CAS No. 1261973-55-0

  • Cat. No. CS-0198898
  • Purity≥97%
  • MDL No.None

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

3-Hydroxy-[1,1'-biphenyl]-4,4'-dicarbonitrile|CS-0198898

Structure of 1261973-55-0

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General Information

  • CAS No. 1261973-55-0
  • Cat. No. CS-0198898
  • Purity ≥97%
  • MDL No. None
  • Storage RT, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₈N₂O
  • Molecular Weight 220.23
  • Synonym(s) 2-Cyano-5-(4-cyanophenyl)phenol
  • SMILES C1=C(C=CC(=C1)C2=CC(=C(C=C2)C#N)O)C#N

Description

3-Hydroxy-[1,1'-biphenyl]-4,4'-dicarbonitrile features a hydroxyl group flanked by two nitrile functionalities on a biphenyl scaffold, enabling dual reactivity for conjugation and functionalization. This electron-deficient architecture supports efficient coupling in cross-coupling processes and facilitates integration into advanced materials and pharmaceutical intermediates under standard conditions.

Application

3-Hydroxy-[1,1'-biphenyl]-4,4'-dicarbonitrile serves as a versatile building block in the synthesis of functionalized biphenyl scaffolds. Its hydroxyl and dual nitrile groups enable selective derivatization via coupling reactions, oxidation, or protection strategies. The molecule exhibits good bench stability and facilitates purification by standard chromatographic methods, making it well-suited for iterative synthetic sequences in medicinal chemistry and materials science applications.

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+H312+H332-H315-H319
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362-P501

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Computational Chemistry Data

  • TPSA   67.81
  • LogP   2.80256
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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