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CS-W001157 4
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(Z)-4-benzylidene-2-methyloxazol-5(4H)-one

  • CAS No. 38879-46-8

  • Cat. No. CS-0320158
  • Purity95+%
  • MDL No.None

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

(Z)-4-benzylidene-2-methyloxazol-5(4H)-one|CS-0320158

Structure of 38879-46-8

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General Information

  • CAS No. 38879-46-8
  • Cat. No. CS-0320158
  • Purity 95+%
  • 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) 4-benzylidene-2-methyl-1,3-oxazol-5(4H)-one
  • SMILES CC1=N/C(=C\C2=CC=CC=C2)/C(=O)O1

Synthesis

  • Route1

    References

    • Baskar; Pandian; Priya; Chadha, Anju Tetrahedron, 2005 , vol. 61, # 52 p. 12296 - 12306
  • Route2

    References

    • Blanco-Lomas, Marina; Campos, Pedro J.; Sampedro, Diego Organic Letters, 2012 , vol. 14, # 17 p. 4334 - 4337
  • Route3
    • (2Z)-2-(Acetylamino)-3-phenyl-2-propenoic acid|CS-0239241
      55065-02-6
    • ~%
    • (Z)-4-benzylidene-2-methyloxazol-5(4H)-one|CS-0320158
      38879-46-8

    References

    • Brenner; Ruefenacht Helvetica Chimica Acta, 1954 , vol. 37, p. 203,208

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

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Computational Chemistry Data

  • TPSA   38.66
  • LogP   2.0027
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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