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CS-W001157 4
Total: USD 88.00

methyl 3-amino-4-methyl-5-nitrobenzoate

  • CAS No. 72922-60-2

  • Cat. No. CS-W004221
  • Purity≥98%
  • MDL No.None

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

methyl 3-amino-4-methyl-5-nitrobenzoate|CS-W004221

Structure of 72922-60-2

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General Information

  • CAS No. 72922-60-2
  • Cat. No. CS-W004221
  • Purity ≥98%
  • MDL No. None
  • Storage RT, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₀N₂O₄
  • Molecular Weight 210.19
  • Synonym(s) None
  • SMILES COC(=O)c1cc(N)c(c(c1)[N+](=O)[O-])C

Synthesis

  • Route1
    • null|null
      49592-71-4
    • ~84%
    • In-stock
      methyl 3-amino-4-methyl-5-nitrobenzoate|CS-W004221
      72922-60-2

    References

    • GLAXO GROUP LIMITED Patent: WO2004/50619 A1, 2004 ; Location in patent: Page 55 ; WO 2004/050619 A1
  • Route2

    References

    • Mochizuki, Akiyoshi; Nagata, Tsutomu; Kanno, Hideyuki; Takano, Daisuke; Kishida, Masamichi; Suzuki, Makoto; Ohta, Toshiharu Bioorganic and Medicinal Chemistry Letters, 2011 , vol. 21, # 24 p. 7337 - 7343

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   95.46
  • LogP   1.27202
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   2

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