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CS-W001157 4
Total: USD 88.00

methyl 2-amino-4-isopropoxy-5-methoxybenzoate

  • CAS No. 50413-53-1

  • Cat. No. CS-0005790
  • Purity≥98%
  • MDL No.MFCD09833970

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

methyl 2-amino-4-isopropoxy-5-methoxybenzoate|CS-0005790

Structure of 50413-53-1

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General Information

  • CAS No. 50413-53-1
  • Cat. No. CS-0005790
  • Purity ≥98%
  • MDL No. MFCD09833970
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₇NO₄
  • Molecular Weight 239.27
  • Synonym(s) Methyl 4-isopropoxy-5-methoxyanthranilate
  • SMILES O=C(OC)C(C(N)=C1)=CC(OC)=C1OC(C)C

Synthesis

  • Route1
    • methyl 4-isopropoxy-5-methoxy-2-nitrobenzoate|CS-0005789
      948553-02-4
    • ~%
    • methyl 2-amino-4-isopropoxy-5-methoxybenzoate|CS-0005790
      50413-53-1

    References

    • Wang, Yanong D.; Miller, Karen; Boschelli, Diane H.; Ye, Fei; Wu, Biqi; Floyd; Powell, Dennis W.; Wissner, Allan; Weber, Jennifer M.; Boschelli, Frank Bioorganic and Medicinal Chemistry Letters, 2000 , vol. 10, # 21 p. 2477 - 2480
  • Route2

    References

    • Wang, Yanong D.; Miller, Karen; Boschelli, Diane H.; Ye, Fei; Wu, Biqi; Floyd; Powell, Dennis W.; Wissner, Allan; Weber, Jennifer M.; Boschelli, Frank Bioorganic and Medicinal Chemistry Letters, 2000 , vol. 10, # 21 p. 2477 - 2480
  • Route3
    • methyl 4-isopropoxy-3-methoxybenzoate|CS-0005788
      3535-27-1
    • ~%
    • methyl 2-amino-4-isopropoxy-5-methoxybenzoate|CS-0005790
      50413-53-1

    References

    • Wang, Yanong D.; Miller, Karen; Boschelli, Diane H.; Ye, Fei; Wu, Biqi; Floyd; Powell, Dennis W.; Wissner, Allan; Weber, Jennifer M.; Boschelli, Frank Bioorganic and Medicinal Chemistry Letters, 2000 , vol. 10, # 21 p. 2477 - 2480

Safety Information

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Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   70.78
  • LogP   1.8512
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   4

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