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Ethyl 2-(4-amino-3-nitrophenyl)acetate

  • CAS No. 104126-70-7

  • Cat. No. CS-0151607
  • Purity≥97%
  • MDL No.MFCD16620936

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

Ethyl 2-(4-amino-3-nitrophenyl)acetate|CS-0151607

Structure of 104126-70-7

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General Information

  • CAS No. 104126-70-7
  • Cat. No. CS-0151607
  • Purity ≥97%
  • MDL No. MFCD16620936
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₂N₂O₄
  • Molecular Weight 224.21
  • Synonym(s) Ethyl 4-amino-3-nitrophenylacetate
  • SMILES CCOC(=O)CC1=CC(=C(C=C1)N)[N+](=O)[O-]

Synthesis

  • Route1

    References

    • BRISTOL-MYERS SQUIBB COMPANY Patent: WO2005/123050 A2, 2005 ; Location in patent: Page/Page column 128 ; WO 2005/123050 A2
  • Route2
    • null|null
      92959-74-5
    • ~%
    • In-stock
      Ethyl 2-(4-amino-3-nitrophenyl)acetate|CS-0151607
      104126-70-7

    References

    • TEMPERO PHARMACEUTICALS, INC.; BALOGLU, Erkan; BOHNERT, Gary, J.; GHOSH, Shomir; LOBERA, Mercedes; SCHMIDT, Darby, R.; SUNG, Leonard Patent: WO2013/19682 A1, 2013 ; Location in patent: Page/Page column 158 ; WO 2013/019682 A1
  • Route3
    • null|null
      64-17-5
    • 2-(4-Amino-3-nitrophenyl)acetic acid|CS-0696041
      116435-82-6
    • ~%
    • In-stock
      Ethyl 2-(4-amino-3-nitrophenyl)acetate|CS-0151607
      104126-70-7

    References

    • Corse et al. Journal of the American Chemical Society, 1948 , vol. 70, p. 2837,2842

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
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   95.46
  • LogP   1.2826
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   4

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