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CS-W001157 4
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4-(2-Hydroxyethyl)benzonitrile

  • CAS No. 69395-13-7

  • Cat. No. CS-W018212
  • Purity≥97%
  • MDL No.MFCD00052461

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

4-(2-Hydroxyethyl)benzonitrile|CS-W018212

Structure of 69395-13-7

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General Information

  • CAS No. 69395-13-7
  • Cat. No. CS-W018212
  • Purity ≥97%
  • MDL No. MFCD00052461
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉NO
  • Molecular Weight 147.18
  • Synonym(s) 4-(2-hydroxyethyl)- (9CI)
  • SMILES OCCC1=CC=C(C=C1)C#N

Description

4-(2-Hydroxyethyl)benzonitrile features a hydroxylated alkyl chain appended to a nitrile-substituted aromatic ring, enabling versatile conjugation and solubility enhancement. This bifunctional architecture supports integration into polymer backbones or bioconjugation workflows under standard conditions.

Application

4-(2-Hydroxyethyl)benzonitrile serves as a versatile synthetic intermediate featuring a nitrile group ortho to a hydroxymethyl functionality, enabling selective transformations in heterocycle construction and side-chain derivatization. Its bench-stable nature and compatibility with standard functional group manipulations facilitate efficient access to bioactive scaffolds and pharmaceutical intermediates.

Synthesis

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    • In-stock
      4-(2-Hydroxyethyl)benzonitrile|CS-W018212
      69395-13-7

    References

    • Chernyak, Natalia; Buchwald, Stephen L. Journal of the American Chemical Society, 2012 , vol. 134, # 43 p. 18147 - 18147,1
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    References

    • Journal of the American Chemical Society, , vol. 134, # 30 p. 12466 - 12469
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    References

    • Helvetica Chimica Acta, , vol. 64, # 5 p. 1688 - 1703

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+H312+H332-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   44.02
  • LogP   1.09308
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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