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CS-W001157 4
Total: USD 88.00

4-Hydroxy-3-nitrobenzyl alcohol

  • CAS No. 41833-13-0

  • Cat. No. CS-W005522
  • Purity≥98%
  • MDL No.MFCD00024249

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

4-Hydroxy-3-nitrobenzyl alcohol|CS-W005522

Structure of 41833-13-0

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General Information

  • CAS No. 41833-13-0
  • Cat. No. CS-W005522
  • Purity ≥98%
  • MDL No. MFCD00024249
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₇NO₄
  • Molecular Weight 169.14
  • Synonym(s) 4-(Hydroxymethyl)-2-nitrophenol
  • SMILES OCC1=CC([N+]([O-])=O)=C(O)C=C1

Application

4-(Hydroxymethyl)-2-nitrophenol serves as a versatile building block for the synthesis of bioactive heterocycles and functionalized aromatic systems. Its ortho-nitro and hydroxymethyl groups enable sequential transformations, including reduction, coupling, and cyclization reactions. The compound exhibits bench stability and facilitates straightforward purification, making it suitable for medicinal chemistry campaigns and process-scale applications.

Synthesis

  • Route1

    References

    • Myers, Jason K.; Cohen, Jonathan D.; Widlanski, Theodore S. Journal of the American Chemical Society, 1995 , vol. 117, # 45 p. 11049 - 11054
  • Route2

    References

    • Chen; Iakovleva; Kesten; Magano; Rodriguez; Sexton; Zhang; Lee Organic Preparations and Procedures International, 2002 , vol. 34, # 6 p. 665 - 670
  • Route3
    • 4-Hydroxybenzyl alcohol Bisoprolol Alcohol Impurity|CS-0229718
      623-05-2
    • ~86%
    • In-stock
      4-Hydroxy-3-nitrobenzyl alcohol|CS-W005522
      41833-13-0
    • In-stock
      4-(Hydroxymethyl)-3-nitrophenol|CS-0160828
      86031-17-6

    References

    • Ouertani, M.; Girard, P.; Kagan, H.B. Tetrahedron Letters, 1982 , vol. 23, # 42 p. 4315 - 4318

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H319
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   83.6
  • LogP   0.7927
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   2

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