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CS-W001157 4
Total: USD 88.00

Methyl 4-acetamido-5-amino-2-methoxybenzoate

  • CAS No. 77495-40-0

  • Cat. No. CS-0580120
  • Purity≥98%
  • MDL No.None

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

Methyl 4-acetamido-5-amino-2-methoxybenzoate|CS-0580120

Structure of 77495-40-0

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General Information

  • CAS No. 77495-40-0
  • Cat. No. CS-0580120
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₄N₂O₄
  • Molecular Weight 238.24
  • Synonym(s) methyl 4-(acetylamino)-5-amino-o-anisate
  • SMILES CC(=O)NC1=C(C=C(C(=C1)OC)C(=O)OC)N

Synthesis

  • Route1
    • 4-Acetylamino-2-methoxy-5-nitro-benzoic acid methyl ester|CS-0002185
      4093-41-8
    • ~93%
    • Methyl 4-acetamido-5-amino-2-methoxybenzoate|CS-0580120
      77495-40-0

    References

    • Eckert, Heiner; Kiesel, Yvonne Angewandte Chemie, 1981 , vol. 93, # 5 p. 477 - 479
  • Route2
    • Methyl 4-acetamido-2-methoxybenzoate Metoclopramide Impurity|CS-0229641
      4093-29-2
    • ~%
    • Methyl 4-acetamido-5-amino-2-methoxybenzoate|CS-0580120
      77495-40-0

    References

    • Hirokawa, Yoshimi; Yamazaki, Hiroshi; Yoshida, Naoyuki; Kato, Shiro Bioorganic and Medicinal Chemistry Letters, 1998 , vol. 8, # 15 p. 1973 - 1978

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   90.65
  • LogP   1.0224
  • H_Acceptors   5
  • H_Donors   2
  • Rotatable_Bonds   3

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