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CS-W001157 4
Total: USD 88.00

5-(P-tolyl)isoxazole-3-carbaldehyde

  • CAS No. 640292-02-0

  • Cat. No. CS-0313942
  • Molecule weight187.19
  • Purity98+%
  • MDL No.None

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

5-(P-tolyl)isoxazole-3-carbaldehyde|CS-0313942

Structure of 640292-02-0

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General Information

  • CAS No. 640292-02-0
  • Cat. No. CS-0313942
  • Purity 98+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₉NO₂
  • Molecular Weight 187.19
  • Synonym(s) 5-(4-Methylphenyl)isoxazole-3-carboxaldehyde
  • SMILES CC1=CC=C(C=C1)C2=CC(=NO2)C=O

Synthesis

  • Route1
    • [5-(4-Methylphenyl)isoxazol-3-yl]methanol|CS-0071509
      640291-93-6
    • ~%
    • 5-(P-tolyl)isoxazole-3-carbaldehyde|CS-0313942
      640292-02-0

    References

    • Synthesis, , # 15 p. 2325 - 2330
  • Route2
    • null|null
      1361109-69-4
    • ~89%
    • 5-(P-tolyl)isoxazole-3-carbaldehyde|CS-0313942
      640292-02-0

    References

    • Potkin; Petkevich; Kletskov; Dikusar; Zubenko; Zhukovskaya; Kazbanov; Pashkevich Russian Journal of Organic Chemistry, 2013 , vol. 49, # 10 p. 1523 - 1533 Zh. Org. Khim., 2013 , vol. 49, # 10 p. 1543 - 1553,11
  • Route3
    • Ethyl 4-(4-methylphenyl)-2,4-dioxobutanoate|CS-0122057
      5814-37-9
    • ~%
    • 5-(P-tolyl)isoxazole-3-carbaldehyde|CS-0313942
      640292-02-0

    References

    • Synthesis, , # 15 p. 2325 - 2330

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   2.46252
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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