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CS-W001157 4
Total: USD 88.00

Methyl 5-(4-aminophenyl)isoxazole-3-carboxylate

  • CAS No. 879216-18-9

  • Cat. No. CS-0255208
  • Purity≥97%
  • MDL No.None

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

Methyl 5-(4-aminophenyl)isoxazole-3-carboxylate|CS-0255208

Structure of 879216-18-9

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General Information

  • CAS No. 879216-18-9
  • Cat. No. CS-0255208
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₀N₂O₃
  • Molecular Weight 218.21
  • Synonym(s) 5-(4-amino-phenyl)-isoxazole-3-carboxylic acid methyl ester
  • SMILES O=C(C1=NOC(C2=CC=C(N)C=C2)=C1)OC

Synthesis

  • Route1
    • Methyl 5-(4-nitrophenyl)isoxazole-3-carboxylate|CS-0452820
      487034-01-5
    • ~93%
    • Methyl 5-(4-aminophenyl)isoxazole-3-carboxylate|CS-0255208
      879216-18-9

    References

    • Srinivasan, Rajavel; Uttamchandani, Mahesh; Yao, Shao Q. Organic Letters, 2006 , vol. 8, # 4 p. 713 - 716
  • Route2
    • p-Nitrophenyl methyl ketone Clenbuterol  Impurity|CS-0229063
      100-19-6
    • ~%
    • Methyl 5-(4-aminophenyl)isoxazole-3-carboxylate|CS-0255208
      879216-18-9

    References

    • Srinivasan, Rajavel; Uttamchandani, Mahesh; Yao, Shao Q. Organic Letters, 2006 , vol. 8, # 4 p. 713 - 716

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H320
Precautionary Statements : P264-P280-P302+P352-P305+P351+P338-P362

Quality Control

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Computational Chemistry Data

  • TPSA   78.35
  • LogP   1.7104
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   2

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