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CS-W001157 4
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2-Nitroterephthalaldehyde

  • CAS No. 39909-72-3

  • Cat. No. CS-0170471
  • Molecule weight179.13
  • Purity≥97%
  • MDL No.None

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

2-Nitroterephthalaldehyde|CS-0170471

Structure of 39909-72-3

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General Information

  • CAS No. 39909-72-3
  • Cat. No. CS-0170471
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₅NO₄
  • Molecular Weight 179.13
  • Synonym(s) 4-FORMYL-6-NITROBENZALDEHYDE
  • SMILES C1=CC(=C(C=C1C=O)[N+](=O)[O-])C=O

Synthesis

  • Route1

    References

    • Hwang, Gil Tae; Son, Hyung Su; Ku, Ja Kang; Kim, Byeang Hyean Journal of the American Chemical Society, 2003 , vol. 125, # 37 p. 11241 - 11248
  • Route2

    References

    • Piggott, Andrew M.; Karuso, Peter Tetrahedron Letters, 2005 , vol. 46, # 47 p. 8241 - 8244
  • Route3

    References

    • Ruggli, Preiswerk Helvetica Chimica Acta, 1939 , vol. 22, p. 478,485

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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   77.28
  • LogP   1.2198
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   3

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