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CS-W001157 4
Total: USD 88.00

4'-Pentyloxy-[1,1'-biphenyl]-4-carbonitrile

  • CAS No. 52364-71-3

  • Cat. No. CS-W014053
  • Molecule weight265.36
  • Purity≥98%
  • MDL No.MFCD00074879

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

4'-Pentyloxy-[1,1'-biphenyl]-4-carbonitrile|CS-W014053

Structure of 52364-71-3

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General Information

  • CAS No. 52364-71-3
  • Cat. No. CS-W014053
  • Purity ≥98%
  • MDL No. MFCD00074879
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₈H₁₉NO
  • Molecular Weight 265.36
  • Synonym(s) 4-Pentyloxy-4-cyano biphenyl
  • SMILES N#CC1=CC=C(C2=CC=C(OCCCCC)C=C2)C=C1

Description

This pentyloxy-substituted biphenyl nitrile features a linear alkyl chain that enhances solubility in organic media while the terminal nitrile group provides a polar handle for further functionalization. The extended aromatic system imparts high thermal stability and favorable liquid crystalline properties, making it suitable for advanced materials applications.

Application

4'-Pentyloxy-[1,1'-biphenyl]-4-carbonitrile serves as a versatile building block in the synthesis of functionalized biphenyl scaffolds. The pentyloxy group enhances solubility and modulates electronic properties, while the terminal nitrile enables downstream transformations such as hydrolysis to carboxylic acids or reductive amination. Its bench-stable nature and compatibility with standard coupling reactions facilitate efficient integration into complex molecular architectures relevant to materials and pharmaceutical research.

Synthesis

  • Route1
    • 4-bromo-4'-(pentyloxy)-1,1'-biphenyl|CS-W004378
      63619-51-2
    • ~87%
    • In-stock
      4'-Pentyloxy-[1,1'-biphenyl]-4-carbonitrile|CS-W014053
      52364-71-3

    References

    • Bumagin, N. A.; Luzikova, E. V.; Beletskaya, I. P. Russian Journal of Organic Chemistry, 1995 , vol. 31, # 11 p. 1480 - 1486 Zhurnal Organicheskoi Khimii, 1995 , vol. 31, # 11 p. 1650 - 1656
  • Route2
    • null|null
      110-53-2
    • In-stock
      4-Cyano-4'-hydroxybiphenyl|CS-W002275
      19812-93-2
    • ~61%
    • In-stock
      4'-Pentyloxy-[1,1'-biphenyl]-4-carbonitrile|CS-W014053
      52364-71-3

    References

    • Ruolene, Yu. I.; Adomenas, P. V.; Adomenene, O. K.; Denis, G. I. Journal of Organic Chemistry USSR (English Translation), 1984 , vol. 20, p. 1192 - 1195 Zhurnal Organicheskoi Khimii, 1984 , vol. 20, # 6 p. 1310 - 1314
  • Route3
    • null|null
      544-92-3
    • 4-bromo-4'-(pentyloxy)-1,1'-biphenyl|CS-W004378
      63619-51-2
    • ~49%
    • In-stock
      4'-Pentyloxy-[1,1'-biphenyl]-4-carbonitrile|CS-W014053
      52364-71-3

    References

    • Goodby; Pindak Molecular crystals and liquid crystals, 1981 , vol. 75, # 1-4 p. 233 - 247

Safety Information

Download SDS
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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   33.02
  • LogP   4.79428
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   6

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