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CS-W001157 4
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3-(3-(M-tolyl)-1,2,4-oxadiazol-5-yl)propanoic acid

  • CAS No. 94192-16-2

  • Cat. No. CS-0321689
  • Molecule weight232.24
  • Purity95+%
  • MDL No.None

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

3-(3-(M-tolyl)-1,2,4-oxadiazol-5-yl)propanoic acid|CS-0321689

Structure of 94192-16-2

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General Information

  • CAS No. 94192-16-2
  • Cat. No. CS-0321689
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₂N₂O₃
  • Molecular Weight 232.24
  • Synonym(s) 3-[3-(3-Methylphenyl)-1,2,4-oxadiazol-5-yl]propanoic acid
  • SMILES CC1=CC(=CC=C1)C2=NOC(=N2)CCC(=O)O

Synthesis

  • Route1

    References

    • Srivastava; Borges Viana de; Bieber Journal of Heterocyclic Chemistry, 1984 , vol. 21, # 4 p. 1193 - 1195
  • Route2
    • null|null
      620-22-4
    • ~%
    • 3-(3-(M-tolyl)-1,2,4-oxadiazol-5-yl)propanoic acid|CS-0321689
      94192-16-2

    References

    • Heterocycles, , vol. 51, # 12 p. 2961 - 2967
  • Route3

    References

    • Neves Filho, Ricardo Antonio Wanderley; Da Silva, Cecilia Aguiar; Da Silva, Clecia Sipriano Borges; Brustein, Vanessa Passos; Navarro, Daniela Maria Do Amaral Ferraz; Dos Santos, Fabio Andre Brayner; Alves, Luiz Carlos; Cavalcanti, Marilia Gabriela Dos Santos; Srivastava, Rajendra Mohan; Carneiro-Da-Cunha, Maria Das Gracas Chemical and Pharmaceutical Bulletin, 2009 , vol. 57, # 8 p. 819 - 825

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   76.22
  • LogP   2.06222
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   4

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