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CS-W001157 4
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3-Phenylisoxazole-5-carbaldehyde

  • CAS No. 72418-40-7

  • Cat. No. CS-0085261
  • Purity≥95%
  • MDL No.MFCD09817543

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

3-Phenylisoxazole-5-carbaldehyde|CS-0085261

Structure of 72418-40-7

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General Information

  • CAS No. 72418-40-7
  • Cat. No. CS-0085261
  • Purity ≥95%
  • MDL No. MFCD09817543
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₇NO₂
  • Molecular Weight 173.17
  • Synonym(s) 3-Phenylisoxazole-5-carboxaldehyde
  • SMILES O=CC1=CC(C2=CC=CC=C2)=NO1

Synthesis

  • Route1

    References

    • Du, Chao; Li, Liqi; Li, Ying; Xie, Zhixiang Angewandte Chemie - International Edition, 2009 , vol. 48, # 42 p. 7853 - 7856
  • Route2
    • null|null
      5221-17-0
    • (E)-N-Hydroxybenzimidoyl chloride|CS-0269703
      81745-44-0
    • ~%
    • 3-Phenylisoxazole-5-carbaldehyde|CS-0085261
      72418-40-7

    References

    • Synlett, , # 6 p. 919 - 923
  • Route3

    References

    • Archives of Pharmacal Research, , vol. 33, # 6 p. 831 - 842

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   43.1
  • LogP   2.1541
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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