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CS-W001157 4
Total: USD 88.00

3-Chloro-4-nitrobenzaldehyde

  • CAS No. 57507-34-3

  • Cat. No. CS-0063901
  • Purity≥95%
  • MDL No.MFCD00968938

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

3-Chloro-4-nitrobenzaldehyde|CS-0063901

Structure of 57507-34-3

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General Information

  • CAS No. 57507-34-3
  • Cat. No. CS-0063901
  • Purity ≥95%
  • MDL No. MFCD00968938
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₄ClNO₃
  • Molecular Weight None
  • Synonym(s) Benzaldehyde,3-chloro-4-nitro
  • SMILES O=CC1=CC=C([N+]([O-])=O)C(Cl)=C1

Description

3-Chloro-4-nitrobenzaldehyde features a chlorine atom at the meta position and a nitro group at the para position relative to the aldehyde, creating a strongly electron-deficient aromatic ring. This configuration enhances reactivity in nucleophilic addition and coupling processes, making it a valuable building block for pharmaceutical intermediates and functional materials.

Application

3-Chloro-4-nitrobenzaldehyde serves as a versatile building block in synthetic organic chemistry, enabling efficient construction of heterocyclic scaffolds and functionalized aromatic systems. Its complementary electron-withdrawing nitro and chloro groups enhance electrophilicity at the aldehyde center, facilitating nucleophilic addition, condensation, and transition-metal-catalyzed coupling reactions. The molecule exhibits good bench stability and is amenable to purification via recrystallization or chromatography, supporting reliable use in medicinal chemistry campaigns and process development workflows.

Synthesis

  • Route1
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      77455-53-9
    • ~79%
    • In-stock
      3-Chloro-4-nitrobenzaldehyde|CS-0063901
      57507-34-3

    References

    • Goh, Swee Hock; Kam, Toh Seok Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1981 , p. 423 - 426
  • Route2
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      1321621-16-2
    • ~%
    • In-stock
      3-Chloro-4-nitrobenzaldehyde|CS-0063901
      57507-34-3

    References

    • Dai, Liyan; Yu, Jie; Chen, Yingqi; Yu, Shichao Synthetic Communications, 2011 , vol. 41, # 20 p. 3078 - 3084
  • Route3

    References

    • Goh, Swee Hock; Kam, Toh Seok Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1981 , p. 423 - 426

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H317
Precautionary Statements : P261-P272-P280-P302+P352-P333+P317-P362+P364-P501

Quality Control

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Computational Chemistry Data

  • TPSA   60.21
  • LogP   2.0607
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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