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CS-W001157 4
Total: USD 88.00

5-Acetyl-2-hydroxy-4-methylthiophene-3-carbonitrile

  • CAS No. 120456-32-8

  • Cat. No. CS-0305226
  • Purity≥98%
  • MDL No.None

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

5-Acetyl-2-hydroxy-4-methylthiophene-3-carbonitrile|CS-0305226

Structure of 120456-32-8

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General Information

  • CAS No. 120456-32-8
  • Cat. No. CS-0305226
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇NO₂S
  • Molecular Weight 181.21
  • Synonym(s) 5-acetyl-2-hydroxy-4-methyl-3-Thiophenecarbonitrile
  • SMILES N#CC1=C(O)SC(C(C)=O)=C1C

Synthesis

  • Route1
    • Ethyl 5-acetyl-2-amino-4-methylthiophene-3-carboxylate|CS-0146628
      57773-41-8
    • ~70%
    • 5-Acetyl-2-hydroxy-4-methylthiophene-3-carbonitrile|CS-0305226
      120456-32-8

    References

    • Gewald, Karl; Gruner, Margit; Hain, Ute; Sueptitz, Gabriele Monatshefte fuer Chemie, 1988 , vol. 119, p. 985 - 992

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   61.09
  • LogP   1.8364
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   1

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