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CS-W001157 4
Total: USD 88.00

1,3-Diethyl 2-[(2-nitrophenyl)methylidene]propanedioate

  • CAS No. 17422-56-9

  • Cat. No. CS-0208653
  • Purity≥95%
  • MDL No.MFCD02176752

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

1,3-Diethyl 2-[(2-nitrophenyl)methylidene]propanedioate|CS-0208653

Structure of 17422-56-9

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General Information

  • CAS No. 17422-56-9
  • Cat. No. CS-0208653
  • Purity ≥95%
  • MDL No. MFCD02176752
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₅NO₆
  • Molecular Weight 293.27
  • Synonym(s) Diethyl 2-(2-nitrobenzylidene)malonate
  • SMILES CCOC(=O)C(=CC1=CC=CC=C1[N+](=O)[O-])C(=O)OCC

Synthesis

  • Route1

    References

    • Ilangovan; Muralidharan; Maruthamuthu Journal of the Korean Chemical Society, 2011 , vol. 55, # 6 p. 1000 - 1006
  • Route2
    • Diethyl 2-benzylidenemalonate|CS-0102405
      5292-53-5
    • ~%
    • 1,3-Diethyl 2-[(2-nitrophenyl)methylidene]propanedioate|CS-0208653
      17422-56-9

    References

    • Journal of the Chemical Society, , vol. 47, p. 155
  • Route3
    • 2-Benzylidenemalonic acid|CS-1154510
      584-45-2
    • ~%
    • 1,3-Diethyl 2-[(2-nitrophenyl)methylidene]propanedioate|CS-0208653
      17422-56-9

    References

    • Journal of the Chemical Society, , vol. 47, p. 155

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   95.74
  • LogP   2.1044
  • H_Acceptors   6
  • H_Donors   0
  • Rotatable_Bonds   6

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