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CS-W001157 4
Total: USD 88.00

N-(6-nitrobenzo[d]thiazol-2-yl)acetamide

  • CAS No. 80395-50-2

  • Cat. No. CS-0313877
  • Purity≥98%
  • MDL No.None

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

N-(6-nitrobenzo[d]thiazol-2-yl)acetamide|CS-0313877

Structure of 80395-50-2

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General Information

  • CAS No. 80395-50-2
  • Cat. No. CS-0313877
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇N₃O₃S
  • Molecular Weight 237.24
  • Synonym(s) N-(6-nitro-1,3-benzothiazol-2-yl)acetamide
  • SMILES CC(NC1=NC2=C(S1)C=C([N+]([O-])=O)C=C2)=O

Synthesis

  • Route1
    • null|null
      66934-12-1
    • ~45%
    • N-(6-nitrobenzo[d]thiazol-2-yl)acetamide|CS-0313877
      80395-50-2

    References

    • Pandeya; Yadav, Meena K.; Mishra, Vaishali; Srivastava, Shobhit; Singh, Bal Krishna Asian Journal of Chemistry, 2011 , vol. 23, # 7 p. 3003 - 3007
  • Route2

    References

    • Amnerkar, Nikhil D.; Bhusari, Kishore P. European Journal of Medicinal Chemistry, 2010 , vol. 45, # 1 p. 149 - 159
  • Route3
    • Benzo[d]thiazol-2-amine  Pramipexole Impurity|CS-0167328
      136-95-8
    • ~%
    • N-(6-nitrobenzo[d]thiazol-2-yl)acetamide|CS-0313877
      80395-50-2

    References

    • Hunter; Jones Journal of the Chemical Society, 1930 , p. 2190,2209

Safety Information

Download SDS
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   85.13
  • LogP   2.1629
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   2

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