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Methyl 6-aminobenzo[d]isoxazole-3-carboxylate

  • CAS No. 57764-47-3

  • Cat. No. CS-0145325
  • Purity≥97%
  • MDL No.None

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

Methyl 6-aminobenzo[d]isoxazole-3-carboxylate|CS-0145325

Structure of 57764-47-3

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General Information

  • CAS No. 57764-47-3
  • Cat. No. CS-0145325
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈N₂O₃
  • Molecular Weight 192.17
  • Synonym(s) 1,2-Benzisoxazole-3-carboxylicacid,6-amino-,methylester(9CI)
  • SMILES O=C(C1=NOC2=CC(N)=CC=C12)OC

Synthesis

  • Route1
    • Methyl 6-nitrobenzo[d]isoxazole-3-carboxylate|CS-0103847
      5453-86-1
    • ~%
    • Methyl 6-aminobenzo[d]isoxazole-3-carboxylate|CS-0145325
      57764-47-3

    References

    • Ried; Gutjahr Chemische Berichte, 1953 , vol. 86, p. 1096,1099

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

Quality Control

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Computational Chemistry Data

  • TPSA   78.35
  • LogP   1.1966
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   1

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