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CS-W001157 4
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3-Nitropropanol

  • CAS No. 25182-84-7

  • Cat. No. CS-0209456
  • Purity≥95%
  • MDL No.MFCD00040626

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

3-Nitropropanol|CS-0209456

Structure of 25182-84-7

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General Information

  • CAS No. 25182-84-7
  • Cat. No. CS-0209456
  • Purity ≥95%
  • MDL No. MFCD00040626
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₃H₇NO₃
  • Molecular Weight 105.09
  • Synonym(s) 3-nitropropan-1-ol
  • SMILES C(C[N+](=O)[O-])CO

Description

3-Nitropropanol is a bench-stable, moisture-tolerant reagent featuring a primary hydroxyl group flanked by a nitro functionality. This arrangement enables direct incorporation into functionalized polymers and bioconjugation workflows, where the nitro group serves as a handle for subsequent reduction or coupling reactions.

Application

3-Nitropropanol serves as a versatile building block in synthetic organic chemistry, enabling the construction of nitro-containing heterocycles and functionalized aliphatic chains. Its dual functionality—primary alcohol and nitro group—supports diverse transformations, including nucleophilic substitutions, reductions to amino alcohols, and participation in cyclization reactions. The compound exhibits good bench stability and facilitates straightforward purification, making it well-suited for iterative synthesis workflows in medicinal chemistry and process development.

Synthesis

  • Route1

    References

    • Oehrlein, Reinhold; Schwab, Wilfried; Ehrler, Rudolf; Jaeger, Volker Synthesis, 1986 , # 7 p. 535 - 538
  • Route2
    • null|null
      58657-26-4
    • ~90%
    • In-stock
      3-Nitropropanol|CS-0209456
      25182-84-7

    References

    • Oehrlein, Reinhold; Schwab, Wilfried; Ehrler, Rudolf; Jaeger, Volker Synthesis, 1986 , # 7 p. 535 - 538
  • Route3

    References

    • Nagano, Tanemasa; Kinoshita, Hideki Bulletin of the Chemical Society of Japan, 2000 , vol. 73, # 7 p. 1605 - 1613

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2810
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301
Precautionary Statements : P264-P270-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   63.37
  • LogP   -0.3545
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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