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CS-W001157 4
Total: USD 88.00

5-Acetylthiophene-2-carbonitrile

  • CAS No. 88653-55-8

  • Cat. No. CS-W018119
  • Purity≥95%
  • MDL No.MFCD00052314

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

5-Acetylthiophene-2-carbonitrile|CS-W018119

Structure of 88653-55-8

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General Information

  • CAS No. 88653-55-8
  • Cat. No. CS-W018119
  • Purity ≥95%
  • MDL No. MFCD00052314
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₅NOS
  • Molecular Weight 151.18
  • Synonym(s) 2-acetyl-5-cyanothiophene
  • SMILES N#CC1=CC=C(C(C)=O)S1

Synthesis

  • Route1
    • Rivaroxaban impurity 4|CS-0166634
      6310-09-4
    • null|null
      557-21-1
    • ~%
    • In-stock
      5-Acetylthiophene-2-carbonitrile|CS-W018119
      88653-55-8

    References

    • Synthesis, , # 1 p. 23 - 25
  • Route2
    • In-stock
      1-(5-Iodothiophen-2-yl)ethanone|CS-W009466
      30955-94-3
    • null|null
      544-92-3
    • ~%
    • In-stock
      5-Acetylthiophene-2-carbonitrile|CS-W018119
      88653-55-8

    References

    • Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999), , p. 557 - 558

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301+H311+H331-H315-H319
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361+P364-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   40.86
  • LogP   1.82238
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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